data_2ba3_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 2ba3 _Structure_validation_residue.Date_analyzed 2016-10-07 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 8.4 t . . . . . 0 N--CA 1.434 -1.254 0 N-CA-C 108.59 -0.893 . . . . 0.0 108.59 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 2.5 t -103.92 134.34 45.44 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.801 0 N-CA-C 104.763 -2.31 . . . . 0.0 104.763 178.344 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 8.8 p -127.32 111.63 25.87 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 N-CA-C 106.295 -1.743 . . . . 0.0 106.295 179.102 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 61.6 ttm-85 -141.68 157.7 44.74 Favored 'General case' 0 CA--C 1.52 -0.206 0 CA-C-N 115.447 -0.797 . . . . 0.0 108.972 -179.807 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 45.0 m -95.7 110.03 22.23 Favored 'General case' 0 N--CA 1.448 -0.544 0 N-CA-C 104.62 -2.363 . . . . 0.0 104.62 178.674 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 12.6 tp -104.24 145.9 29.56 Favored 'General case' 0 C--O 1.237 0.428 0 N-CA-C 106.839 -1.541 . . . . 0.0 106.839 179.841 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 33.1 mtt180 -127.74 161.3 29.28 Favored 'General case' 0 N--CA 1.453 -0.298 0 C-N-CA 123.529 0.732 . . . . 0.0 110.306 -179.538 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 95.1 m-85 -149.49 159.03 44.65 Favored 'General case' 0 N--CA 1.465 0.298 0 C-N-CA 124.311 1.045 . . . . 0.0 108.818 -179.117 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -84.91 169.87 15.15 Favored Pre-proline 0 CA--C 1.542 0.658 0 N-CA-C 108.477 -0.935 . . . . 0.0 108.477 178.578 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -61.49 -32.64 88.5 Favored 'Trans proline' 0 C--N 1.349 0.602 0 C-N-CA 122.04 1.827 . . . . 0.0 111.811 -178.834 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 93.4 t -66.23 -58.38 6.86 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.419 0 C-N-CA 125.885 1.674 . . . . 0.0 108.511 179.526 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -56.66 -40.15 74.99 Favored 'General case' 0 CA--C 1.521 -0.148 0 CA-C-N 118.146 0.43 . . . . 0.0 111.389 -179.722 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 32.8 t70 -65.49 -42.68 91.89 Favored 'General case' 0 CA--C 1.512 -0.483 0 C-N-CA 123.989 0.916 . . . . 0.0 110.994 179.647 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 34.9 tt0 -60.28 -52.64 64.43 Favored 'General case' 0 N--CA 1.448 -0.56 0 N-CA-C 107.738 -1.208 . . . . 0.0 107.738 179.328 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 57.0 m -56.41 -56.46 20.92 Favored 'General case' 0 N--CA 1.451 -0.385 0 C-N-CA 123.046 0.538 . . . . 0.0 110.161 -179.194 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 27.8 mt -58.82 -43.38 88.02 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.536 0 N-CA-C 112.412 0.523 . . . . 0.0 112.412 -178.576 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 31.6 ttt180 -59.14 -47.0 86.9 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 118.616 0.644 . . . . 0.0 109.814 179.63 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 2.3 mptm? -66.72 -40.89 88.57 Favored 'General case' 0 CA--C 1.529 0.153 0 CA-C-O 119.456 -0.307 . . . . 0.0 110.248 -179.726 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 8.4 tptt -64.73 -44.41 90.26 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-N 118.994 0.815 . . . . 0.0 111.118 -179.361 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -61.55 -53.16 59.96 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 124.377 1.071 . . . . 0.0 111.12 -179.856 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 3.7 tp10 -65.18 -36.18 83.39 Favored 'General case' 0 C--O 1.233 0.227 0 N-CA-C 113.419 0.896 . . . . 0.0 113.419 -177.137 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 30.3 t70 -67.83 -40.88 83.73 Favored 'General case' 0 CA--C 1.517 -0.322 0 N-CA-C 109.894 -0.41 . . . . 0.0 109.894 179.112 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 9.4 t -75.7 -14.05 60.33 Favored 'General case' 0 N--CA 1.452 -0.326 0 CA-C-N 115.784 -0.643 . . . . 0.0 111.68 -179.337 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 71.92 39.89 58.39 Favored Glycine 0 CA--C 1.526 0.733 0 N-CA-C 108.955 -1.658 . . . . 0.0 108.955 -178.876 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 84.2 mt -128.32 137.1 51.79 Favored 'General case' 0 N--CA 1.448 -0.552 0 N-CA-C 103.109 -2.922 . . . . 0.0 103.109 179.021 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 5.7 t -70.6 155.67 40.44 Favored 'General case' 0 C--N 1.319 -0.728 0 N-CA-C 106.053 -1.832 . . . . 0.0 106.053 178.226 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 74.3 t -52.73 -40.93 36.79 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.452 0 O-C-N 121.033 -1.042 . . . . 0.0 111.988 -179.601 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 65.3 p -61.97 -46.85 87.44 Favored 'General case' 0 N--CA 1.468 0.431 0 CA-C-N 119.494 1.043 . . . . 0.0 110.921 -179.855 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.88 -45.04 91.16 Favored 'General case' 0 C--O 1.219 -0.51 0 N-CA-C 108.238 -1.023 . . . . 0.0 108.238 178.311 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 92.5 t80 -54.35 -48.85 70.96 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 123.806 0.842 . . . . 0.0 109.928 -179.835 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 5.1 mm -56.45 -65.32 0.4 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.241 0 C-N-CA 125.051 1.34 . . . . 0.0 110.88 179.667 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 10.6 ptt180 -57.53 -39.96 77.74 Favored 'General case' 0 C--O 1.22 -0.463 0 CA-C-O 118.898 -0.572 . . . . 0.0 110.442 -178.833 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 8.9 t30 -58.31 -56.98 15.09 Favored 'General case' 0 N--CA 1.453 -0.277 0 C-N-CA 124.07 0.948 . . . . 0.0 109.298 179.432 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -60.11 -34.2 73.17 Favored 'General case' 0 CA--C 1.532 0.264 0 CA-C-O 121.362 0.601 . . . . 0.0 111.132 -179.797 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -67.74 -26.84 66.34 Favored 'General case' 0 CA--C 1.538 0.508 0 O-C-N 121.283 -0.886 . . . . 0.0 113.187 -179.885 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 6.1 mt -100.4 -31.59 11.24 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-N 119.32 0.964 . . . . 0.0 112.069 -178.652 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 38.4 m-80 . . . . . 0 C--O 1.247 0.958 0 C-N-CA 124.712 1.205 . . . . 0.0 108.134 179.583 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 6.0 t . . . . . 0 N--CA 1.437 -1.09 0 N-CA-C 107.066 -1.457 . . . . 0.0 107.066 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 2.4 t -101.07 154.39 4.68 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.911 0 N-CA-C 103.77 -2.678 . . . . 0.0 103.77 177.278 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 11.2 p -145.81 115.39 1.56 Allowed 'Isoleucine or valine' 0 N--CA 1.444 -0.73 0 N-CA-C 106.524 -1.658 . . . . 0.0 106.524 179.468 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 49.0 ttm-85 -152.96 161.19 42.84 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.615 0.721 . . . . 0.0 110.721 -179.63 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -96.92 110.88 23.3 Favored 'General case' 0 N--CA 1.446 -0.646 0 N-CA-C 105.484 -2.043 . . . . 0.0 105.484 179.219 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -109.17 108.89 19.7 Favored 'General case' 0 C--O 1.236 0.357 0 N-CA-C 106.537 -1.653 . . . . 0.0 106.537 -179.887 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 5.7 mtp180 -87.37 153.28 21.57 Favored 'General case' 0 C--N 1.334 -0.065 0 C-N-CA 122.73 0.412 . . . . 0.0 110.254 -179.916 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 22' ' ' PHE . . . . . . . . . . . . . 87.7 m-85 -141.2 143.77 34.39 Favored 'General case' 0 N--CA 1.468 0.471 0 N-CA-C 107.97 -1.122 . . . . 0.0 107.97 179.921 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 1.2 m -74.1 167.03 39.41 Favored Pre-proline 0 CA--C 1.538 0.499 0 CA-C-O 118.254 -0.879 . . . . 0.0 108.986 179.882 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 24' ' ' PRO . . . . . . . . . . . . . 61.0 Cg_endo -67.97 -33.2 26.71 Favored 'Trans proline' 0 C--N 1.346 0.427 0 C-N-CA 121.91 1.74 . . . . 0.0 112.283 -179.181 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 25' ' ' VAL . . . . . . . . . . . . . 61.9 t -64.8 -52.02 59.61 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.413 0 N-CA-C 107.847 -1.168 . . . . 0.0 107.847 179.637 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 1.4 mp0 -63.32 -44.55 94.62 Favored 'General case' 0 C--O 1.222 -0.368 0 C-N-CA 124.156 0.982 . . . . 0.0 110.477 179.276 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 27' ' ' ASP . . . . . . . . . . . . . 6.7 t70 -57.13 -45.22 83.67 Favored 'General case' 0 C--O 1.223 -0.298 0 C-N-CA 125.714 1.606 . . . . 0.0 111.446 -179.685 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 28' ' ' GLU . . . . . . . . . . . . . 46.3 tt0 -63.42 -46.52 85.98 Favored 'General case' 0 N--CA 1.448 -0.549 0 N-CA-C 108.614 -0.884 . . . . 0.0 108.614 178.866 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 52.0 m -62.27 -47.87 82.43 Favored 'General case' 0 C--N 1.333 -0.11 0 O-C-N 121.695 -0.628 . . . . 0.0 110.524 179.226 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 79.2 mt -63.37 -38.4 82.07 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.634 0 CA-C-O 122.415 1.102 . . . . 0.0 108.399 179.759 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 70.0 ttt180 -64.66 -38.3 90.52 Favored 'General case' 0 C--N 1.327 -0.378 0 O-C-N 118.881 -2.387 . . . . 0.0 109.29 178.226 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -71.8 -48.22 47.94 Favored 'General case' 0 C--N 1.33 -0.262 0 C-N-CA 123.937 0.895 . . . . 0.0 112.462 -179.151 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 12.7 mptt -66.45 -46.11 77.53 Favored 'General case' 0 C--O 1.225 -0.221 0 CA-C-O 118.026 -0.988 . . . . 0.0 108.604 -179.857 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 34' ' ' ALA . . . . . . . . . . . . . . . -53.7 -56.31 18.45 Favored 'General case' 0 CA--C 1.528 0.123 0 CA-C-N 119.317 0.962 . . . . 0.0 110.183 179.284 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 5.2 tp10 -63.17 -39.28 94.19 Favored 'General case' 0 C--O 1.232 0.153 0 N-CA-C 112.578 0.585 . . . . 0.0 112.578 -178.303 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 36' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -69.3 -35.57 76.12 Favored 'General case' 0 N--CA 1.46 0.055 0 CA-C-N 118.453 0.57 . . . . 0.0 110.355 179.622 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 37' ' ' SER . . . . . . . . . . . . . 13.9 t -75.92 -12.14 60.09 Favored 'General case' 0 CA--C 1.541 0.628 0 N-CA-C 108.911 -0.774 . . . . 0.0 108.911 178.234 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 75.44 29.6 59.68 Favored Glycine 0 C--N 1.339 0.696 0 O-C-N 121.126 -0.984 . . . . 0.0 110.74 -179.504 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 39' ' ' LEU . . . . . . . . . . . . . 87.6 mt -120.9 159.05 26.32 Favored 'General case' 0 N--CA 1.445 -0.71 0 C-N-CA 125.469 1.508 . . . . 0.0 107.929 179.425 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 40' ' ' THR . . . . . 0.438 HG21 ' H ' ' B' ' 43' ' ' ALA . 1.6 t -81.39 151.9 27.71 Favored 'General case' 0 C--N 1.322 -0.609 0 N-CA-C 104.109 -2.552 . . . . 0.0 104.109 176.799 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 41' ' ' VAL . . . . . . . . . . . . . 42.2 t -48.17 -42.09 10.73 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.659 0 C-N-CA 125.217 1.407 . . . . 0.0 109.627 178.516 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 42' ' ' SER . . . . . . . . . . . . . 13.2 p -60.37 -51.08 71.04 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-N 119.648 1.113 . . . . 0.0 111.39 179.465 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 43' ' ' ALA . . . . . 0.438 ' H ' HG21 ' B' ' 40' ' ' THR . . . -61.04 -42.85 99.25 Favored 'General case' 0 C--O 1.223 -0.302 0 C-N-CA 123.601 0.761 . . . . 0.0 109.023 179.193 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 44' ' ' TYR . . . . . . . . . . . . . 46.8 t80 -58.39 -50.63 72.98 Favored 'General case' 0 N--CA 1.445 -0.709 0 N-CA-C 109.444 -0.576 . . . . 0.0 109.444 179.486 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 45' ' ' ILE . . . . . . . . . . . . . 22.7 mm -55.44 -61.03 1.21 Allowed 'Isoleucine or valine' 0 C--N 1.34 0.189 0 C-N-CA 124.036 0.934 . . . . 0.0 110.214 179.762 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 46' ' ' ARG . . . . . . . . . . . . . 26.9 ptt180 -53.92 -49.11 69.37 Favored 'General case' 0 C--O 1.223 -0.33 0 CA-C-O 118.967 -0.54 . . . . 0.0 111.384 -178.566 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 47' ' ' ASN . . . . . . . . . . . . . 24.0 t30 -60.34 -51.76 68.14 Favored 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 124.195 0.998 . . . . 0.0 112.692 -179.075 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -61.45 -35.57 77.97 Favored 'General case' 0 C--O 1.222 -0.344 0 O-C-N 123.82 0.7 . . . . 0.0 111.528 -179.858 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 49' ' ' ALA . . . . . . . . . . . . . . . -77.07 -24.25 51.92 Favored 'General case' 0 N--CA 1.447 -0.595 0 N-CA-C 113.575 0.954 . . . . 0.0 113.575 -178.79 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 24.8 mt -84.96 -40.75 16.58 Favored 'General case' 0 CA--C 1.513 -0.47 0 CA-C-N 118.734 0.697 . . . . 0.0 111.172 -179.671 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 51' ' ' ASN . . . . . . . . . . . . . 69.5 m-80 . . . . . 0 C--O 1.247 0.924 0 CA-C-O 116.301 -1.809 . . . . 0.0 108.952 179.808 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 5.3 t . . . . . 0 N--CA 1.432 -1.364 0 N-CA-C 108.457 -0.942 . . . . 0.0 108.457 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 16.0 t -101.77 157.61 4.46 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.578 0 N-CA-C 106.445 -1.687 . . . . 0.0 106.445 178.611 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 7.2 p -151.16 107.58 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 N-CA-C 105.723 -1.954 . . . . 0.0 105.723 178.05 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 4.2 ttt85 -152.66 146.63 25.31 Favored 'General case' 0 C--O 1.235 0.334 0 O-C-N 122.085 -0.385 . . . . 0.0 111.669 -178.954 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -76.97 119.03 20.14 Favored 'General case' 0 N--CA 1.449 -0.484 0 N-CA-C 104.739 -2.319 . . . . 0.0 104.739 177.212 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 13.0 tp -123.62 113.14 18.28 Favored 'General case' 0 N--CA 1.442 -0.835 0 C-N-CA 123.275 0.63 . . . . 0.0 109.371 179.788 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 7.7 mtm180 -98.31 162.24 13.28 Favored 'General case' 0 N--CA 1.453 -0.281 0 C-N-CA 125.629 1.572 . . . . 0.0 111.384 179.846 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 78.0 m-85 -144.24 150.99 38.81 Favored 'General case' 0 CA--C 1.53 0.208 0 C-N-CA 125.817 1.647 . . . . 0.0 107.004 179.421 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -75.26 175.43 4.08 Favored Pre-proline 0 CA--C 1.551 1.012 0 CA-C-N 119.83 1.195 . . . . 0.0 108.859 179.329 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 43.6 Cg_endo -66.71 -43.38 7.43 Favored 'Trans proline' 0 C--N 1.35 0.634 0 CA-C-N 122.144 1.802 . . . . 0.0 113.067 -178.67 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 96.3 t -64.38 -41.71 93.17 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.218 0 N-CA-C 108.615 -0.883 . . . . 0.0 108.615 179.893 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -63.39 -47.75 80.73 Favored 'General case' 0 N--CA 1.452 -0.364 0 C-N-CA 123.664 0.785 . . . . 0.0 109.284 179.911 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 5.5 t70 -59.71 -49.91 75.91 Favored 'General case' 0 CA--C 1.507 -0.688 0 C-N-CA 125.837 1.655 . . . . 0.0 111.847 -179.898 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -62.29 -44.41 96.59 Favored 'General case' 0 N--CA 1.447 -0.613 0 N-CA-C 108.123 -1.066 . . . . 0.0 108.123 -179.64 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 30.8 m -61.17 -53.36 57.94 Favored 'General case' 0 N--CA 1.454 -0.265 0 N-CA-C 108.698 -0.852 . . . . 0.0 108.698 178.872 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 58.1 mt -58.16 -43.61 85.93 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.329 0 CA-C-N 119.038 0.835 . . . . 0.0 110.211 -179.644 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 23.2 ttt180 -63.22 -47.67 81.53 Favored 'General case' 0 C--N 1.332 -0.161 0 O-C-N 121.457 -0.777 . . . . 0.0 110.089 179.91 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 4.7 mptp? -63.71 -46.4 85.61 Favored 'General case' 0 C--O 1.225 -0.229 0 CA-C-N 118.82 0.736 . . . . 0.0 109.796 -179.786 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 13.5 mptt -64.82 -44.67 89.11 Favored 'General case' 0 CA--C 1.529 0.143 0 CA-C-O 118.057 -0.973 . . . . 0.0 110.237 -179.566 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -57.37 -56.14 25.67 Favored 'General case' 0 C--O 1.231 0.1 0 C-N-CA 124.656 1.183 . . . . 0.0 109.609 179.018 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 29.9 tt0 -60.63 -40.9 93.67 Favored 'General case' 0 N--CA 1.449 -0.488 0 C-N-CA 123.633 0.773 . . . . 0.0 112.132 -178.269 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 27.6 t70 -68.3 -30.27 69.22 Favored 'General case' 0 CA--C 1.53 0.173 0 C-N-CA 124.349 1.06 . . . . 0.0 110.138 179.449 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 10.1 t -82.18 -6.41 59.18 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 124.58 1.152 . . . . 0.0 109.375 178.153 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 69.2 29.27 72.12 Favored Glycine 0 CA--C 1.527 0.789 0 O-C-N 120.581 -1.325 . . . . 0.0 109.991 -179.265 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 75.9 mt -122.68 158.83 29.2 Favored 'General case' 0 N--CA 1.447 -0.597 0 C-N-CA 125.836 1.654 . . . . 0.0 108.137 179.99 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -84.91 147.49 26.73 Favored 'General case' 0 C--N 1.32 -0.704 0 N-CA-C 104.036 -2.579 . . . . 0.0 104.036 177.235 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 39.8 t -46.8 -41.05 5.06 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.478 0 C-N-CA 125.356 1.463 . . . . 0.0 110.241 178.494 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -60.75 -49.44 77.48 Favored 'General case' 0 CA--C 1.548 0.873 0 CA-C-N 119.622 1.101 . . . . 0.0 110.587 179.515 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -64.47 -41.84 96.26 Favored 'General case' 0 C--O 1.224 -0.261 0 C-N-CA 125.229 1.411 . . . . 0.0 110.203 178.898 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 81.3 t80 -58.35 -52.54 65.19 Favored 'General case' 0 N--CA 1.452 -0.347 0 N-CA-C 108.087 -1.079 . . . . 0.0 108.087 179.256 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 16.6 mm -52.44 -59.8 1.4 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.298 0 C-N-CA 124.227 1.011 . . . . 0.0 110.698 179.499 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 29.5 ptt180 -59.05 -44.17 91.76 Favored 'General case' 0 C--O 1.222 -0.381 0 CA-C-O 118.72 -0.657 . . . . 0.0 112.304 -178.944 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 29.4 t30 -59.91 -52.35 65.8 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-N 118.657 0.662 . . . . 0.0 110.808 -178.922 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -62.99 -29.21 70.64 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 123.649 0.78 . . . . 0.0 111.502 179.438 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -80.5 -15.41 56.77 Favored 'General case' 0 CA--C 1.532 0.283 0 N-CA-C 113.791 1.034 . . . . 0.0 113.791 -179.677 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 31.0 mt -101.96 -42.89 5.95 Favored 'General case' 0 CA--C 1.522 -0.131 0 CA-C-N 120.173 1.351 . . . . 0.0 112.124 -179.606 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 60.8 m-80 . . . . . 0 C--O 1.245 0.836 0 O-C-N 124.159 0.912 . . . . 0.0 109.487 -179.437 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 5.4 t . . . . . 0 N--CA 1.436 -1.126 0 CA-C-O 122.234 1.016 . . . . 0.0 109.73 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 23.2 t -122.85 143.82 34.45 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.615 0 N-CA-C 105.537 -2.023 . . . . 0.0 105.537 179.234 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 6.4 p -143.74 97.66 0.58 Allowed 'Isoleucine or valine' 0 N--CA 1.443 -0.784 0 CA-C-O 122.471 1.129 . . . . 0.0 109.564 178.761 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 1.2 ttt85 -144.18 155.05 43.74 Favored 'General case' 0 N--CA 1.45 -0.463 0 CA-C-N 114.617 -1.174 . . . . 0.0 108.372 179.292 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -90.87 134.76 34.21 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 104.096 -2.557 . . . . 0.0 104.096 177.559 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 11.3 tp -116.04 154.92 29.04 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-N 118.883 0.765 . . . . 0.0 109.673 179.497 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 18.4 mmt180 -126.54 150.28 48.89 Favored 'General case' 0 C--O 1.232 0.17 0 C-N-CA 125.762 1.625 . . . . 0.0 110.203 -178.93 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 22' ' ' PHE . . . . . . . . . . . . . 91.9 m-85 -145.82 143.91 29.94 Favored 'General case' 0 C--O 1.232 0.165 0 C-N-CA 125.587 1.555 . . . . 0.0 107.366 178.578 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 2.4 m -68.99 170.84 7.57 Favored Pre-proline 0 CA--C 1.542 0.652 0 CA-C-N 119.258 0.935 . . . . 0.0 109.997 179.323 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 24' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_endo -65.75 -44.81 7.43 Favored 'Trans proline' 0 C--N 1.349 0.584 0 C-N-CA 121.452 1.435 . . . . 0.0 113.139 -178.277 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 25' ' ' VAL . . . . . . . . . . . . . 21.8 t -65.87 -38.99 83.43 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.52 0 C-N-CA 123.918 0.887 . . . . 0.0 109.387 179.788 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 98.6 mt-10 -66.5 -40.93 89.52 Favored 'General case' 0 C--O 1.226 -0.173 0 C-N-CA 123.879 0.872 . . . . 0.0 108.858 179.488 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 27' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -62.89 -50.26 71.6 Favored 'General case' 0 CA--C 1.514 -0.412 0 C-N-CA 123.903 0.881 . . . . 0.0 109.518 179.195 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 28' ' ' GLU . . . . . . . . . . . . . 91.4 mt-10 -57.02 -43.35 81.78 Favored 'General case' 0 C--N 1.332 -0.191 0 C-N-CA 124.245 1.018 . . . . 0.0 109.542 178.689 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 80.0 m -63.23 -59.92 4.09 Favored 'General case' 0 N--CA 1.451 -0.421 0 N-CA-C 109.599 -0.519 . . . . 0.0 109.599 179.52 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 98.0 mt -58.09 -39.07 71.03 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.449 0 C-N-CA 123.961 0.904 . . . . 0.0 111.891 -178.686 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 24.1 ttt-85 -67.08 -48.4 68.34 Favored 'General case' 0 N--CA 1.453 -0.277 0 O-C-N 121.399 -0.813 . . . . 0.0 108.977 -179.855 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 2.1 mptp? -60.94 -46.98 88.52 Favored 'General case' 0 CA--C 1.515 -0.386 0 N-CA-C 108.82 -0.807 . . . . 0.0 108.82 -179.89 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 58.7 mmtt -63.59 -43.91 95.56 Favored 'General case' 0 C--O 1.22 -0.448 0 CA-C-O 118.053 -0.975 . . . . 0.0 110.619 -179.498 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 34' ' ' ALA . . . . . . . . . . . . . . . -58.21 -50.94 71.79 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 119.6 1.091 . . . . 0.0 109.237 178.618 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 27.6 tt0 -60.06 -45.03 94.23 Favored 'General case' 0 N--CA 1.454 -0.255 0 C-N-CA 124.144 0.977 . . . . 0.0 111.779 -179.185 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 36' ' ' ASP . . . . . . . . . . . . . 25.3 t0 -68.73 -37.53 79.53 Favored 'General case' 0 C--N 1.331 -0.215 0 C-N-CA 125.332 1.453 . . . . 0.0 110.418 -179.362 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 37' ' ' SER . . . . . . . . . . . . . 32.8 t -73.0 -11.2 60.48 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 126.409 1.884 . . . . 0.0 110.04 178.723 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 68.33 26.89 74.02 Favored Glycine 0 CA--C 1.525 0.689 0 O-C-N 121.246 -0.909 . . . . 0.0 111.259 -179.447 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 39' ' ' LEU . . . . . . . . . . . . . 82.2 mt -121.17 142.29 50.03 Favored 'General case' 0 N--CA 1.445 -0.678 0 C-N-CA 125.2 1.4 . . . . 0.0 107.588 -179.717 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 40' ' ' THR . . . . . . . . . . . . . 2.0 t -64.61 146.31 54.86 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 105.367 -2.086 . . . . 0.0 105.367 177.036 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 41' ' ' VAL . . . . . . . . . . . . . 2.2 t -45.94 -51.27 3.65 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.469 0 C-N-CA 124.748 1.219 . . . . 0.0 111.538 179.303 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 42' ' ' SER . . . . . . . . . . . . . 1.5 p -58.09 -31.54 67.21 Favored 'General case' 0 CA--C 1.544 0.741 0 O-C-N 120.325 -1.485 . . . . 0.0 112.686 -179.199 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -78.46 -40.8 34.57 Favored 'General case' 0 C--O 1.224 -0.256 0 C-N-CA 124.694 1.198 . . . . 0.0 109.047 177.71 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 44' ' ' TYR . . . . . . . . . . . . . 24.6 t80 -57.37 -51.85 67.74 Favored 'General case' 0 N--CA 1.455 -0.224 0 N-CA-C 108.409 -0.959 . . . . 0.0 108.409 179.442 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 45' ' ' ILE . . . . . . . . . . . . . 28.0 mm -54.16 -60.67 1.27 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.309 0 C-N-CA 123.358 0.663 . . . . 0.0 111.676 179.499 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 46' ' ' ARG . . . . . . . . . . . . . 9.9 ptt180 -56.48 -43.19 79.39 Favored 'General case' 0 C--O 1.224 -0.264 0 CA-C-O 119.171 -0.442 . . . . 0.0 111.23 -178.519 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 47' ' ' ASN . . . . . . . . . . . . . 39.0 t30 -60.41 -55.93 27.63 Favored 'General case' 0 N--CA 1.446 -0.642 0 C-N-CA 123.885 0.874 . . . . 0.0 111.944 -179.198 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -60.2 -33.33 72.09 Favored 'General case' 0 CA--C 1.53 0.185 0 O-C-N 124.17 0.919 . . . . 0.0 112.564 -179.069 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 49' ' ' ALA . . . . . . . . . . . . . . . -74.0 -24.33 59.57 Favored 'General case' 0 C--N 1.333 -0.145 0 N-CA-C 113.986 1.106 . . . . 0.0 113.986 -178.929 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 24.0 mt -100.19 -43.13 6.41 Favored 'General case' 0 CA--C 1.514 -0.407 0 N-CA-C 113.423 0.897 . . . . 0.0 113.423 -178.672 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 51' ' ' ASN . . . . . . . . . . . . . 26.6 m-80 . . . . . 0 C--O 1.249 1.062 0 C-N-CA 125.179 1.392 . . . . 0.0 107.649 -177.514 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 4.7 t . . . . . 0 N--CA 1.446 -0.635 0 N-CA-C 107.266 -1.383 . . . . 0.0 107.266 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 13.5 t -131.32 157.98 43.26 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 N-CA-C 106.01 -1.848 . . . . 0.0 106.01 -179.673 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 13.6 p -149.16 116.98 0.9 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.444 0 N-CA-C 106.881 -1.525 . . . . 0.0 106.881 178.898 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 25.1 ttt180 -153.26 161.22 42.63 Favored 'General case' 0 N--CA 1.466 0.339 0 O-C-N 121.691 -0.631 . . . . 0.0 110.153 -179.847 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -106.32 127.79 53.51 Favored 'General case' 0 C--O 1.24 0.58 0 N-CA-C 105.052 -2.203 . . . . 0.0 105.052 179.102 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -128.24 120.31 26.92 Favored 'General case' 0 CA--C 1.529 0.162 0 C-N-CA 124.284 1.034 . . . . 0.0 109.602 -178.448 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 15.6 mmt85 -83.84 156.97 22.2 Favored 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 124.811 1.244 . . . . 0.0 110.665 -179.768 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 70.6 m-85 -144.61 155.31 43.56 Favored 'General case' 0 N--CA 1.463 0.224 0 C-N-CA 125.355 1.462 . . . . 0.0 108.315 178.55 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 39.1 m -79.9 171.08 13.34 Favored Pre-proline 0 CA--C 1.545 0.783 0 C-N-CA 123.976 0.91 . . . . 0.0 108.904 179.095 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 35.0 Cg_endo -64.75 -54.61 0.68 Allowed 'Trans proline' 0 C--N 1.351 0.674 0 C-N-CA 121.961 1.774 . . . . 0.0 112.027 -178.012 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 33.7 t -58.91 -42.02 84.68 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.337 0 C-N-CA 123.359 0.664 . . . . 0.0 110.013 -179.716 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -63.55 -50.24 70.29 Favored 'General case' 0 C--O 1.227 -0.092 0 C-N-CA 123.289 0.635 . . . . 0.0 110.856 -179.576 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 7.1 t70 -59.65 -47.04 87.18 Favored 'General case' 0 C--O 1.221 -0.398 0 C-N-CA 123.859 0.864 . . . . 0.0 110.224 179.218 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 44.8 tt0 -58.18 -44.71 88.15 Favored 'General case' 0 N--CA 1.449 -0.523 0 C-N-CA 124.628 1.171 . . . . 0.0 109.217 179.945 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 68.7 m -60.42 -52.18 66.32 Favored 'General case' 0 CA--C 1.538 0.51 0 N-CA-C 108.793 -0.818 . . . . 0.0 108.793 178.886 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 72.3 mt -59.26 -45.99 92.63 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.211 0 C-N-CA 123.379 0.672 . . . . 0.0 109.752 -179.684 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 62.8 ttt180 -61.06 -40.98 95.7 Favored 'General case' 0 C--O 1.234 0.255 0 C-N-CA 124.237 1.015 . . . . 0.0 110.308 -179.525 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -68.34 -52.65 31.0 Favored 'General case' 0 CA--C 1.52 -0.201 0 CA-C-N 118.644 0.656 . . . . 0.0 110.33 179.461 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 75.9 mttt -60.99 -43.44 98.85 Favored 'General case' 0 CA--C 1.518 -0.262 0 CA-C-N 119.021 0.828 . . . . 0.0 111.122 -178.584 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -56.82 -54.16 49.64 Favored 'General case' 0 N--CA 1.452 -0.337 0 C-N-CA 123.936 0.894 . . . . 0.0 109.477 179.235 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 31.3 tt0 -62.82 -41.46 99.33 Favored 'General case' 0 N--CA 1.455 -0.185 0 N-CA-C 112.908 0.707 . . . . 0.0 112.908 -178.516 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -62.95 -39.3 94.22 Favored 'General case' 0 N--CA 1.453 -0.309 0 C-N-CA 125.451 1.501 . . . . 0.0 108.574 179.449 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 8.7 t -78.89 -9.76 59.59 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 123.815 0.846 . . . . 0.0 109.967 177.776 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 64.71 27.08 71.51 Favored Glycine 0 N--CA 1.442 -0.928 0 C-N-CA 125.955 1.74 . . . . 0.0 112.078 -179.458 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 13.3 mt -118.3 138.1 52.61 Favored 'General case' 0 CA--C 1.518 -0.287 0 N-CA-C 103.851 -2.648 . . . . 0.0 103.851 179.292 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 5.5 t -56.4 151.85 12.4 Favored 'General case' 0 CA--C 1.534 0.333 0 N-CA-C 108.968 -0.753 . . . . 0.0 108.968 178.942 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 24.4 t -52.14 -37.1 21.57 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.363 0 N-CA-C 109.106 -0.702 . . . . 0.0 109.106 177.865 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 12.2 m -62.09 -30.46 71.02 Favored 'General case' 0 CA--C 1.541 0.605 0 O-C-N 121.138 -0.976 . . . . 0.0 112.646 179.893 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -81.82 -46.51 14.07 Favored 'General case' 0 CA--C 1.516 -0.356 0 N-CA-C 106.535 -1.654 . . . . 0.0 106.535 177.852 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 82.0 t80 -51.39 -52.68 43.71 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 124.091 0.956 . . . . 0.0 109.327 -179.684 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 13.1 mm -53.0 -64.01 0.43 Allowed 'Isoleucine or valine' 0 C--N 1.34 0.173 0 C-N-CA 126.079 1.752 . . . . 0.0 110.801 179.479 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -54.61 -47.95 72.78 Favored 'General case' 0 C--O 1.22 -0.487 0 CA-C-O 119.133 -0.461 . . . . 0.0 111.305 -178.2 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 11.3 t30 -58.76 -49.79 76.35 Favored 'General case' 0 N--CA 1.445 -0.713 0 C-N-CA 123.455 0.702 . . . . 0.0 112.427 -178.877 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -64.98 -31.97 73.46 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 123.388 0.675 . . . . 0.0 111.146 179.337 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -75.86 -35.65 59.85 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 124.156 0.982 . . . . 0.0 113.05 -179.742 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 22.5 mt -77.54 -44.56 28.18 Favored 'General case' 0 CA--C 1.515 -0.398 0 N-CA-C 113.817 1.043 . . . . 0.0 113.817 -177.81 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 57.9 m-80 . . . . . 0 C--O 1.249 1.047 0 CA-C-O 117.774 -1.108 . . . . 0.0 111.233 179.632 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 2.9 t . . . . . 0 N--CA 1.445 -0.713 0 N-CA-C 107.391 -1.337 . . . . 0.0 107.391 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 2.9 t -141.02 154.54 21.1 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.719 0 N-CA-C 106.432 -1.692 . . . . 0.0 106.432 179.24 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 14.0 p -141.53 114.51 4.37 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.646 0 N-CA-C 106.725 -1.583 . . . . 0.0 106.725 178.579 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 7.9 ttt180 -149.26 148.56 29.71 Favored 'General case' 0 N--CA 1.47 0.553 0 N-CA-C 108.166 -1.05 . . . . 0.0 108.166 178.691 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 2.6 m -101.2 116.66 33.33 Favored 'General case' 0 C--O 1.236 0.376 0 N-CA-C 107.982 -1.118 . . . . 0.0 107.982 -179.614 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -115.28 159.96 20.36 Favored 'General case' 0 C--O 1.235 0.296 0 C-N-CA 124.412 1.085 . . . . 0.0 109.97 -179.508 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 1.5 mtt85 -125.99 162.9 24.19 Favored 'General case' 0 N--CA 1.443 -0.787 0 C-N-CA 124.711 1.204 . . . . 0.0 110.721 178.439 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 22' ' ' PHE . . . . . . . . . . . . . 92.9 m-85 -140.65 146.66 38.18 Favored 'General case' 0 N--CA 1.454 -0.27 0 C-N-CA 124.985 1.314 . . . . 0.0 107.996 179.749 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 14.8 m -73.91 168.75 23.06 Favored Pre-proline 0 CA--C 1.548 0.887 0 N-CA-C 106.714 -1.587 . . . . 0.0 106.714 178.276 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 24' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_endo -63.0 -44.27 16.41 Favored 'Trans proline' 0 N--CA 1.459 -0.523 0 C-N-CA 121.456 1.437 . . . . 0.0 112.825 -178.112 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 25' ' ' VAL . . . . . . . . . . . . . 75.1 t -64.87 -40.22 88.33 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.276 0 C-N-CA 123.894 0.878 . . . . 0.0 110.168 179.609 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 81.9 mt-10 -62.76 -51.05 68.66 Favored 'General case' 0 N--CA 1.453 -0.316 0 N-CA-C 109.494 -0.558 . . . . 0.0 109.494 -179.343 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 27' ' ' ASP . . . . . . . . . . . . . 17.7 t70 -59.28 -47.48 85.2 Favored 'General case' 0 CA--C 1.511 -0.543 0 C-N-CA 125.165 1.386 . . . . 0.0 111.428 179.875 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 28' ' ' GLU . . . . . . . . . . . . . 73.2 tt0 -57.6 -46.91 83.46 Favored 'General case' 0 N--CA 1.447 -0.594 0 C-N-CA 124.589 1.156 . . . . 0.0 109.108 179.421 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 55.9 m -61.82 -57.86 10.22 Favored 'General case' 0 CA--C 1.533 0.323 0 N-CA-C 109.618 -0.512 . . . . 0.0 109.618 179.067 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 90.2 mt -53.92 -46.13 64.19 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.1 0 C-N-CA 123.539 0.736 . . . . 0.0 110.671 -178.066 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 63.0 ttt180 -61.14 -47.92 83.98 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-O 118.688 -0.672 . . . . 0.0 110.72 -179.665 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -65.24 -46.32 81.04 Favored 'General case' 0 CA--C 1.517 -0.302 0 CA-C-O 118.617 -0.706 . . . . 0.0 110.214 -179.073 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 65.1 mttt -59.22 -47.82 83.93 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-N 118.935 0.789 . . . . 0.0 110.276 -179.497 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 34' ' ' ALA . . . . . . . . . . . . . . . -57.86 -56.45 21.82 Favored 'General case' 0 N--CA 1.45 -0.457 0 C-N-CA 124.229 1.011 . . . . 0.0 110.248 179.802 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 17.4 tt0 -62.94 -34.6 77.82 Favored 'General case' 0 C--N 1.33 -0.253 0 C-N-CA 123.796 0.839 . . . . 0.0 112.783 -177.681 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 36' ' ' ASP . . . . . . . . . . . . . 5.3 t70 -67.94 -42.36 81.12 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 108.263 -1.014 . . . . 0.0 108.263 178.715 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 37' ' ' SER . . . . . . . . . . . . . 31.8 t -71.98 -27.0 62.47 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-O 121.244 0.545 . . . . 0.0 109.861 179.412 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 97.72 -4.05 61.26 Favored Glycine 0 CA--C 1.523 0.541 0 C-N-CA 125.203 1.382 . . . . 0.0 111.877 -179.712 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 39' ' ' LEU . . . . . . . . . . . . . 31.8 mt -87.85 144.29 26.67 Favored 'General case' 0 N--CA 1.438 -1.038 0 C-N-CA 125.255 1.422 . . . . 0.0 107.168 -179.959 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 40' ' ' THR . . . . . . . . . . . . . 1.8 t -68.39 147.25 52.35 Favored 'General case' 0 C--N 1.313 -0.988 0 N-CA-C 106.039 -1.837 . . . . 0.0 106.039 177.56 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 41' ' ' VAL . . . . . . . . . . . . . 53.7 t -49.88 -38.26 13.77 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.446 0 O-C-N 121.524 -0.735 . . . . 0.0 110.926 179.144 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 42' ' ' SER . . . . . . . . . . . . . 14.1 p -61.67 -37.78 85.33 Favored 'General case' 0 CA--C 1.533 0.327 0 O-C-N 121.071 -1.018 . . . . 0.0 111.836 179.651 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -73.73 -43.3 59.54 Favored 'General case' 0 C--N 1.341 0.211 0 C-N-CA 125.802 1.641 . . . . 0.0 108.3 178.492 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 44' ' ' TYR . . . . . . . . . . . . . 47.2 t80 -56.08 -50.01 72.2 Favored 'General case' 0 N--CA 1.451 -0.378 0 C-N-CA 123.721 0.809 . . . . 0.0 109.323 179.489 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 45' ' ' ILE . . . . . . . . . . . . . 12.8 mm -52.56 -63.93 0.43 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.291 0 C-N-CA 124.786 1.235 . . . . 0.0 110.727 179.765 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 46' ' ' ARG . . . . . . . . . . . . . 15.2 ptp180 -55.36 -48.06 74.83 Favored 'General case' 0 C--O 1.226 -0.161 0 C-N-CA 123.602 0.761 . . . . 0.0 112.081 -179.5 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 47' ' ' ASN . . . . . . . . . . . . . 29.9 t30 -59.42 -53.17 61.19 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-O 118.717 -0.659 . . . . 0.0 111.141 -179.347 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -63.28 -32.76 74.26 Favored 'General case' 0 C--O 1.224 -0.24 0 C-N-CA 123.753 0.821 . . . . 0.0 112.283 -179.574 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 49' ' ' ALA . . . . . . . . . . . . . . . -68.62 -37.03 79.42 Favored 'General case' 0 C--O 1.232 0.167 0 O-C-N 121.758 -0.589 . . . . 0.0 111.145 179.931 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 21.4 mt -79.8 -41.36 26.62 Favored 'General case' 0 CA--C 1.521 -0.147 0 CA-C-O 119.1 -0.476 . . . . 0.0 110.439 -179.687 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 51' ' ' ASN . . . . . . . . . . . . . 57.5 m-80 . . . . . 0 C--O 1.253 1.286 0 C-N-CA 124.335 1.054 . . . . 0.0 111.295 -178.492 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 4.0 t . . . . . 0 N--CA 1.446 -0.637 0 CA-C-O 121.769 0.795 . . . . 0.0 108.883 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 2.4 t -119.05 156.48 21.12 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 C-N-CA 125.954 1.701 . . . . 0.0 106.623 178.485 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 14.8 p -144.47 123.47 6.72 Favored 'Isoleucine or valine' 0 C--O 1.238 0.499 0 N-CA-C 106.73 -1.582 . . . . 0.0 106.73 178.928 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 13.7 ttm180 -154.51 164.92 37.95 Favored 'General case' 0 C--O 1.234 0.266 0 O-C-N 121.674 -0.641 . . . . 0.0 109.516 179.416 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 3.8 m -107.84 135.32 49.44 Favored 'General case' 0 N--CA 1.448 -0.542 0 N-CA-C 105.327 -2.101 . . . . 0.0 105.327 178.721 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 43.9 mt -129.91 108.76 10.37 Favored 'General case' 0 CA--C 1.512 -0.513 0 N-CA-C 108.584 -0.895 . . . . 0.0 108.584 179.293 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -77.86 150.32 34.19 Favored 'General case' 0 N--CA 1.45 -0.462 0 N-CA-C 107.213 -1.403 . . . . 0.0 107.213 177.555 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 66.6 m-85 -144.02 161.74 38.0 Favored 'General case' 0 C--O 1.237 0.433 0 N-CA-C 106.508 -1.664 . . . . 0.0 106.508 178.185 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 36.7 m -92.71 167.6 14.21 Favored Pre-proline 0 CA--C 1.538 0.483 0 C-N-CA 124.58 1.152 . . . . 0.0 109.407 179.453 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -63.01 -29.81 75.82 Favored 'Trans proline' 0 C--N 1.347 0.45 0 C-N-CA 122.861 2.374 . . . . 0.0 113.306 -178.808 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 71.6 t -68.63 -54.61 19.99 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.455 0 N-CA-C 107.381 -1.34 . . . . 0.0 107.381 179.134 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 28.0 mt-10 -59.45 -44.08 93.04 Favored 'General case' 0 C--O 1.223 -0.302 0 C-N-CA 125.231 1.412 . . . . 0.0 110.58 179.964 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -62.13 -48.54 79.69 Favored 'General case' 0 CA--C 1.512 -0.489 0 C-N-CA 125.667 1.587 . . . . 0.0 110.919 179.984 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 76.7 tt0 -59.69 -42.4 92.89 Favored 'General case' 0 N--CA 1.453 -0.284 0 N-CA-C 108.509 -0.923 . . . . 0.0 108.509 178.486 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 18.8 m -62.26 -60.31 3.77 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 123.461 0.704 . . . . 0.0 109.559 -179.932 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 96.5 mt -57.87 -39.54 71.83 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.163 0 C-N-CA 124.195 0.998 . . . . 0.0 111.064 -178.965 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 19.8 ttt180 -69.36 -37.11 77.46 Favored 'General case' 0 C--N 1.332 -0.186 0 O-C-N 120.907 -1.12 . . . . 0.0 110.675 -179.81 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 2.2 mptp? -70.15 -49.24 52.55 Favored 'General case' 0 CA--C 1.517 -0.29 0 N-CA-C 109.385 -0.598 . . . . 0.0 109.385 178.973 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 3.2 mptp? -63.81 -46.48 84.97 Favored 'General case' 0 CA--C 1.511 -0.521 0 C-N-CA 124.478 1.111 . . . . 0.0 110.682 -178.462 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -59.27 -53.96 52.3 Favored 'General case' 0 N--CA 1.452 -0.368 0 CA-C-N 119.137 0.881 . . . . 0.0 109.794 179.611 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 41.9 tt0 -62.45 -38.06 88.3 Favored 'General case' 0 CA--C 1.532 0.282 0 N-CA-C 112.011 0.374 . . . . 0.0 112.011 -178.099 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 31.6 t70 -69.64 -37.95 76.97 Favored 'General case' 0 C--O 1.233 0.228 0 C-N-CA 123.535 0.734 . . . . 0.0 109.878 179.194 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 10.4 t -72.37 -8.04 52.84 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 124.224 1.01 . . . . 0.0 108.639 177.802 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 71.03 6.72 60.99 Favored Glycine 0 C--N 1.341 0.86 0 C-N-CA 126.098 1.808 . . . . 0.0 113.108 -179.488 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 15.3 mt -101.66 161.05 13.93 Favored 'General case' 0 N--CA 1.441 -0.888 0 C-N-CA 126.161 1.784 . . . . 0.0 107.127 -179.491 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' THR . . . . . 0.441 HG21 ' H ' ' A' ' 43' ' ' ALA . 5.1 t -81.04 155.16 26.48 Favored 'General case' 0 C--N 1.313 -1.012 0 O-C-N 120.42 -1.425 . . . . 0.0 107.641 178.781 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 20.8 t -51.65 -39.75 24.41 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.407 0 C-N-CA 124.87 1.268 . . . . 0.0 110.099 178.659 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 15.2 p -61.44 -50.46 72.7 Favored 'General case' 0 CA--C 1.534 0.35 0 O-C-N 121.907 -0.496 . . . . 0.0 109.987 179.303 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . 0.441 ' H ' HG21 ' A' ' 40' ' ' THR . . . -59.86 -48.84 80.05 Favored 'General case' 0 CA--C 1.519 -0.217 0 C-N-CA 125.737 1.615 . . . . 0.0 109.959 178.997 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 81.9 t80 -51.14 -49.56 60.61 Favored 'General case' 0 N--CA 1.45 -0.47 0 C-N-CA 124.814 1.246 . . . . 0.0 109.803 -179.873 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 13.9 mm -57.67 -65.01 0.46 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.394 0 C-N-CA 124.067 0.947 . . . . 0.0 110.62 179.373 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 7.2 ptp180 -53.81 -41.65 67.54 Favored 'General case' 0 C--N 1.341 0.198 0 CA-C-O 117.886 -1.054 . . . . 0.0 111.906 -178.424 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 28.9 t30 -61.88 -55.89 25.02 Favored 'General case' 0 N--CA 1.453 -0.312 0 C-N-CA 124.014 0.926 . . . . 0.0 110.127 179.68 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -61.5 -29.55 70.05 Favored 'General case' 0 C--O 1.224 -0.248 0 C-N-CA 123.176 0.59 . . . . 0.0 112.288 -179.133 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -77.6 -26.38 50.62 Favored 'General case' 0 N--CA 1.451 -0.412 0 N-CA-C 113.148 0.796 . . . . 0.0 113.148 179.885 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 18.5 mt -88.92 -42.69 11.67 Favored 'General case' 0 CA--C 1.514 -0.413 0 O-C-N 121.031 -1.043 . . . . 0.0 109.346 -179.679 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 5.5 m-80 . . . . . 0 C--O 1.242 0.683 0 O-C-N 124.628 1.205 . . . . 0.0 107.883 179.461 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 1.3 t . . . . . 0 N--CA 1.443 -0.784 0 CA-C-O 122.152 0.977 . . . . 0.0 110.923 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 41.0 t -117.76 146.66 21.94 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 C-N-CA 126.813 2.045 . . . . 0.0 105.902 179.02 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 7.2 p -146.07 107.76 0.77 Allowed 'Isoleucine or valine' 0 N--CA 1.451 -0.418 0 N-CA-C 105.343 -2.095 . . . . 0.0 105.343 178.326 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 9.8 ttt180 -149.52 166.43 29.21 Favored 'General case' 0 CA--C 1.509 -0.633 0 N-CA-C 109.978 -0.378 . . . . 0.0 109.978 -179.739 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 19.2 m -105.49 145.7 30.54 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 108.282 -1.007 . . . . 0.0 108.282 179.699 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 26.7 mt -135.5 143.5 45.84 Favored 'General case' 0 N--CA 1.443 -0.816 0 N-CA-C 106.481 -1.674 . . . . 0.0 106.481 177.405 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -114.91 143.2 45.52 Favored 'General case' 0 N--CA 1.448 -0.526 0 N-CA-C 105.434 -2.061 . . . . 0.0 105.434 178.976 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 22' ' ' PHE . . . . . . . . . . . . . 95.8 m-85 -136.46 140.98 43.5 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 106.145 -1.798 . . . . 0.0 106.145 179.632 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 4.6 m -74.87 169.08 21.76 Favored Pre-proline 0 CA--C 1.543 0.699 0 C-N-CA 123.33 0.652 . . . . 0.0 109.272 179.802 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 24' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo -67.06 -28.92 40.85 Favored 'Trans proline' 0 C--N 1.348 0.525 0 C-N-CA 122.025 1.817 . . . . 0.0 113.573 -178.294 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 25' ' ' VAL . . . . . . . . . . . . . 46.8 t -74.51 -48.34 35.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 N-CA-C 107.38 -1.341 . . . . 0.0 107.38 -179.666 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 26.8 mp0 -59.51 -43.28 93.42 Favored 'General case' 0 N--CA 1.448 -0.566 0 C-N-CA 125.071 1.348 . . . . 0.0 109.206 179.181 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 27' ' ' ASP . . . . . . . . . . . . . 19.3 t70 -63.65 -50.27 69.96 Favored 'General case' 0 C--O 1.224 -0.246 0 C-N-CA 124.252 1.021 . . . . 0.0 109.84 179.136 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 28' ' ' GLU . . . . . . . . . . . . . 64.1 tt0 -60.89 -17.21 49.33 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 125.138 1.375 . . . . 0.0 110.915 179.254 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 27.2 m -91.92 -61.44 1.63 Allowed 'General case' 0 N--CA 1.453 -0.317 0 N-CA-C 107.671 -1.233 . . . . 0.0 107.671 178.427 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 96.4 mt -58.17 -29.34 36.86 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.484 0 C-N-CA 124.109 0.964 . . . . 0.0 112.462 -178.388 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 61.8 ttt180 -73.58 -32.19 64.0 Favored 'General case' 0 C--N 1.328 -0.355 0 O-C-N 120.358 -1.464 . . . . 0.0 110.185 -179.959 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 3.7 mptp? -81.03 -50.51 9.58 Favored 'General case' 0 N--CA 1.456 -0.135 0 C-N-CA 123.584 0.754 . . . . 0.0 112.274 -179.475 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 4.6 mptp? -61.15 -42.06 97.88 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-O 118.95 -0.547 . . . . 0.0 110.785 -177.847 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 34' ' ' ALA . . . . . . . . . . . . . . . -60.1 -54.55 44.56 Favored 'General case' 0 N--CA 1.455 -0.213 0 C-N-CA 124.155 0.982 . . . . 0.0 108.794 179.614 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 16.4 tt0 -61.14 -36.38 79.63 Favored 'General case' 0 CA--C 1.532 0.273 0 N-CA-C 112.435 0.532 . . . . 0.0 112.435 -178.522 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 36' ' ' ASP . . . . . . . . . . . . . 5.8 t70 -70.85 -34.16 71.37 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 124.095 0.958 . . . . 0.0 110.279 178.88 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 37' ' ' SER . . . . . . . . . . . . . 9.6 t -79.69 -6.0 56.32 Favored 'General case' 0 N--CA 1.453 -0.309 0 C-N-CA 124.207 1.003 . . . . 0.0 111.906 179.388 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 68.03 20.55 72.9 Favored Glycine 0 CA--C 1.534 1.237 0 N-CA-C 110.642 -0.983 . . . . 0.0 110.642 -178.299 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 39' ' ' LEU . . . . . . . . . . . . . 55.4 mt -115.61 128.84 56.23 Favored 'General case' 0 CA--C 1.514 -0.413 0 N-CA-C 104.994 -2.224 . . . . 0.0 104.994 179.943 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 40' ' ' THR . . . . . . . . . . . . . 1.2 t -63.38 152.9 36.81 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 107.659 -1.237 . . . . 0.0 107.659 178.987 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 41' ' ' VAL . . . . . . . . . . . . . 40.2 t -47.64 -40.8 7.73 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.638 0 C-N-CA 124.454 1.102 . . . . 0.0 110.455 178.366 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 42' ' ' SER . . . . . . . . . . . . . 9.8 m -63.35 -36.62 84.3 Favored 'General case' 0 CA--C 1.546 0.791 0 O-C-N 119.827 -1.795 . . . . 0.0 111.667 179.809 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -74.82 -45.57 42.52 Favored 'General case' 0 C--O 1.223 -0.294 0 C-N-CA 125.612 1.565 . . . . 0.0 110.687 178.766 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 44' ' ' TYR . . . . . . . . . . . . . 4.1 t80 -55.89 -41.07 73.91 Favored 'General case' 0 CA--C 1.537 0.444 0 CA-C-N 119.158 0.89 . . . . 0.0 109.42 179.527 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 45' ' ' ILE . . . . . . . . . . . . . 13.2 mm -57.63 -64.31 0.55 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.37 0 CA-C-N 118.847 0.749 . . . . 0.0 109.763 178.897 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 46' ' ' ARG . . . . . . . . . . . . . 12.8 ptp180 -56.0 -46.53 78.71 Favored 'General case' 0 C--O 1.219 -0.508 0 CA-C-O 118.257 -0.878 . . . . 0.0 111.368 -179.15 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 47' ' ' ASN . . . . . . . . . . . . . 35.3 t30 -54.69 -54.43 41.92 Favored 'General case' 0 N--CA 1.452 -0.33 0 CA-C-N 118.989 0.813 . . . . 0.0 110.678 -179.557 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -64.13 -29.58 70.69 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 123.82 0.848 . . . . 0.0 112.35 -179.955 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 49' ' ' ALA . . . . . . . . . . . . . . . -78.75 -14.82 59.07 Favored 'General case' 0 CA--C 1.53 0.186 0 C-N-CA 124.372 1.069 . . . . 0.0 113.277 -179.557 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 11.8 mt -112.83 -35.4 5.48 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-N 119.241 0.928 . . . . 0.0 113.15 -179.264 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 51' ' ' ASN . . . . . . . . . . . . . 70.3 m-80 . . . . . 0 CA--C 1.5 -0.978 0 CA-C-O 116.339 -1.791 . . . . 0.0 112.279 -177.503 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 5.8 t . . . . . 0 N--CA 1.444 -0.754 0 CA-C-O 122.323 1.059 . . . . 0.0 108.803 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 20.3 t -96.57 145.39 8.85 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.621 0 N-CA-C 104.603 -2.369 . . . . 0.0 104.603 178.062 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 8.0 p -143.38 107.45 1.23 Allowed 'Isoleucine or valine' 0 C--O 1.238 0.485 0 N-CA-C 104.909 -2.256 . . . . 0.0 104.909 178.295 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 10.0 ttt85 -141.94 162.14 36.21 Favored 'General case' 0 C--O 1.237 0.411 0 CA-C-O 121.423 0.63 . . . . 0.0 111.826 -179.251 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 42.0 m -92.12 103.43 15.92 Favored 'General case' 0 N--CA 1.445 -0.7 0 N-CA-C 105.144 -2.169 . . . . 0.0 105.144 179.503 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 18.6 tp -110.58 111.64 22.99 Favored 'General case' 0 C--N 1.323 -0.553 0 C-N-CA 123.931 0.893 . . . . 0.0 108.75 179.836 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 11.5 mmm-85 -94.51 150.96 19.73 Favored 'General case' 0 N--CA 1.451 -0.38 0 C-N-CA 124.637 1.175 . . . . 0.0 109.879 179.785 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 87.2 m-85 -128.82 179.09 5.91 Favored 'General case' 0 C--O 1.237 0.412 0 C-N-CA 125.853 1.661 . . . . 0.0 108.096 178.457 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 62.6 m -112.06 173.94 2.59 Favored Pre-proline 0 CA--C 1.543 0.687 0 CA-C-O 117.563 -1.208 . . . . 0.0 109.041 179.853 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 45.1 Cg_endo -68.51 -48.9 0.96 Allowed 'Trans proline' 0 C--N 1.35 0.617 0 CA-C-N 121.557 1.592 . . . . 0.0 113.478 -177.15 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 20.4 t -66.17 -37.2 79.21 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.432 0 N-CA-C 109.657 -0.498 . . . . 0.0 109.657 -179.499 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 49.8 mt-10 -64.62 -50.86 65.49 Favored 'General case' 0 C--N 1.341 0.212 0 N-CA-C 108.788 -0.819 . . . . 0.0 108.788 179.636 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 6.0 t70 -57.52 -45.34 85.11 Favored 'General case' 0 CA--C 1.513 -0.463 0 C-N-CA 124.972 1.309 . . . . 0.0 110.617 179.642 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -60.51 -46.19 91.06 Favored 'General case' 0 N--CA 1.45 -0.437 0 C-N-CA 123.296 0.638 . . . . 0.0 109.438 179.703 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 27.8 m -60.7 -57.08 14.2 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 123.179 0.592 . . . . 0.0 109.94 179.671 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 40.5 mt -58.03 -43.13 84.43 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.317 0 C-N-CA 124.927 1.291 . . . . 0.0 110.992 -178.815 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 43.5 ttt180 -62.29 -48.2 80.92 Favored 'General case' 0 CA--C 1.516 -0.363 0 C-N-CA 123.359 0.663 . . . . 0.0 110.499 -179.604 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -63.91 -46.11 86.27 Favored 'General case' 0 CA--C 1.518 -0.251 0 C-N-CA 120.659 -0.416 . . . . 0.0 110.09 -178.842 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 8.2 tptm -63.7 -44.63 93.07 Favored 'General case' 0 N--CA 1.455 -0.181 0 CA-C-O 119.615 -0.231 . . . . 0.0 110.993 -179.349 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -59.93 -51.64 68.82 Favored 'General case' 0 N--CA 1.454 -0.254 0 C-N-CA 124.041 0.936 . . . . 0.0 110.579 179.754 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 39.2 tt0 -64.65 -36.66 84.96 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-O 119.113 -0.47 . . . . 0.0 110.829 -179.053 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 27.5 t70 -67.69 -43.98 78.82 Favored 'General case' 0 CA--C 1.518 -0.267 0 C-N-CA 123.954 0.902 . . . . 0.0 109.802 179.147 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 31.2 t -73.23 -14.79 61.4 Favored 'General case' 0 CA--C 1.542 0.663 0 CA-C-O 122.105 0.955 . . . . 0.0 109.645 179.025 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 77.88 8.73 87.26 Favored Glycine 0 N--CA 1.443 -0.894 0 O-C-N 120.542 -1.349 . . . . 0.0 114.829 178.902 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 15.0 mt -114.41 118.36 33.62 Favored 'General case' 0 CA--C 1.515 -0.403 0 N-CA-C 103.742 -2.688 . . . . 0.0 103.742 179.252 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 12.7 t -48.13 158.75 0.23 Allowed 'General case' 0 C--N 1.329 -0.3 0 C-N-CA 124.811 1.244 . . . . 0.0 111.569 -179.292 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 69.7 t -46.06 -44.29 5.23 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.342 0 C-N-CA 125.038 1.335 . . . . 0.0 112.02 -178.885 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 11.8 p -62.72 -41.62 99.25 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-N 120.498 1.499 . . . . 0.0 111.848 -179.994 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -67.71 -49.98 59.87 Favored 'General case' 0 C--O 1.218 -0.569 0 N-CA-C 108.106 -1.072 . . . . 0.0 108.106 178.222 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 45.8 t80 -52.22 -51.38 58.59 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 123.963 0.905 . . . . 0.0 108.647 179.28 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 6.2 mm -55.61 -62.62 0.76 Allowed 'Isoleucine or valine' 0 C--O 1.225 -0.194 0 C-N-CA 125.704 1.602 . . . . 0.0 110.744 179.608 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 21.4 ptt180 -59.13 -45.7 90.24 Favored 'General case' 0 C--O 1.222 -0.343 0 CA-C-O 119.07 -0.491 . . . . 0.0 111.626 -178.162 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 21.7 t30 -58.25 -52.43 65.59 Favored 'General case' 0 N--CA 1.45 -0.464 0 C-N-CA 124.222 1.009 . . . . 0.0 111.099 -178.905 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -67.97 -25.62 65.53 Favored 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 124.333 1.053 . . . . 0.0 112.148 179.736 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -80.71 -41.97 22.72 Favored 'General case' 0 N--CA 1.454 -0.261 0 CA-C-N 118.428 0.558 . . . . 0.0 111.444 179.699 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 27.9 mt -73.2 -45.11 58.16 Favored 'General case' 0 CA--C 1.516 -0.355 0 C-N-CA 123.561 0.745 . . . . 0.0 111.809 -178.96 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 68.2 m-80 . . . . . 0 C--O 1.251 1.14 0 CA-C-O 116.961 -1.495 . . . . 0.0 111.136 -178.421 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 13.1 t . . . . . 0 N--CA 1.443 -0.822 0 CA-C-O 122.516 1.151 . . . . 0.0 111.428 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 2.6 t -143.73 91.22 0.41 Allowed 'Isoleucine or valine' 0 N--CA 1.441 -0.915 0 N-CA-C 103.757 -2.682 . . . . 0.0 103.757 178.378 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 8.1 p -92.27 118.6 38.15 Favored 'Isoleucine or valine' 0 C--O 1.239 0.528 0 N-CA-C 104.332 -2.47 . . . . 0.0 104.332 178.459 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 13.1 ttt85 -145.58 176.57 9.52 Favored 'General case' 0 C--O 1.233 0.229 0 O-C-N 121.432 -0.792 . . . . 0.0 109.732 -178.783 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 25.7 m -114.98 90.19 3.28 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 105.487 -2.042 . . . . 0.0 105.487 -179.546 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -95.06 106.12 18.09 Favored 'General case' 0 C--N 1.324 -0.533 0 C-N-CA 124.474 1.11 . . . . 0.0 108.176 -179.126 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 12.0 mtm180 -91.52 155.9 18.07 Favored 'General case' 0 C--O 1.238 0.467 0 CA-C-N 118.342 0.519 . . . . 0.0 111.357 178.892 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 22' ' ' PHE . . . . . . . . . . . . . 96.8 m-85 -136.44 143.97 44.17 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 107.801 -1.185 . . . . 0.0 107.801 179.796 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -75.21 168.17 30.07 Favored Pre-proline 0 CA--C 1.543 0.694 0 C-N-CA 123.555 0.742 . . . . 0.0 109.888 179.45 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 24' ' ' PRO . . . . . . . . . . . . . 34.2 Cg_endo -61.35 -40.83 45.91 Favored 'Trans proline' 0 C--N 1.348 0.541 0 C-N-CA 122.808 2.338 . . . . 0.0 113.283 -177.921 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 25' ' ' VAL . . . . . . . . . . . . . 38.5 t -72.15 -33.57 47.16 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.491 0 N-CA-C 109.271 -0.64 . . . . 0.0 109.271 179.562 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 68.6 mt-10 -65.94 -46.07 79.53 Favored 'General case' 0 C--N 1.343 0.316 0 N-CA-C 107.802 -1.184 . . . . 0.0 107.802 178.722 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 27' ' ' ASP . . . . . . . . . . . . . 4.0 t0 -58.9 -48.71 80.48 Favored 'General case' 0 CA--C 1.512 -0.494 0 C-N-CA 127.022 2.129 . . . . 0.0 110.075 179.216 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 28' ' ' GLU . . . . . . . . . . . . . 71.8 tt0 -56.38 -51.03 69.83 Favored 'General case' 0 N--CA 1.455 -0.204 0 CA-C-N 118.892 0.769 . . . . 0.0 109.874 179.53 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 60.8 m -60.94 -56.6 19.21 Favored 'General case' 0 N--CA 1.451 -0.422 0 C-N-CA 122.591 0.356 . . . . 0.0 110.934 -178.846 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 97.8 mt -57.26 -49.87 78.5 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.477 0 C-N-CA 123.001 0.52 . . . . 0.0 111.091 -178.57 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 53.2 ttt180 -59.84 -44.82 93.87 Favored 'General case' 0 CA--C 1.521 -0.171 0 CA-C-N 119.143 0.883 . . . . 0.0 111.284 -179.462 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.42 -45.48 87.39 Favored 'General case' 0 CA--C 1.51 -0.596 0 CA-C-O 118.765 -0.636 . . . . 0.0 110.693 -178.927 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 17.9 tptm -67.26 -46.96 72.13 Favored 'General case' 0 N--CA 1.453 -0.277 0 N-CA-C 109.61 -0.515 . . . . 0.0 109.61 -179.351 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 34' ' ' ALA . . . . . . . . . . . . . . . -56.86 -54.79 42.43 Favored 'General case' 0 N--CA 1.453 -0.292 0 C-N-CA 125.318 1.447 . . . . 0.0 112.693 -179.705 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 5.4 tt0 -70.2 -26.71 64.01 Favored 'General case' 0 C--O 1.233 0.235 0 N-CA-C 112.205 0.446 . . . . 0.0 112.205 -177.372 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 36' ' ' ASP . . . . . . . . . . . . . 15.0 t70 -75.04 -42.54 56.94 Favored 'General case' 0 C--N 1.331 -0.236 0 O-C-N 121.553 -0.717 . . . . 0.0 109.091 178.255 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 37' ' ' SER . . . . . . . . . . . . . 39.6 t -69.83 -23.81 63.36 Favored 'General case' 0 C--O 1.235 0.324 0 C-N-CA 126.017 1.727 . . . . 0.0 111.32 -179.812 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 81.09 23.18 59.65 Favored Glycine 0 CA--C 1.53 0.997 0 N-CA-C 110.355 -1.098 . . . . 0.0 110.355 -178.689 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 39' ' ' LEU . . . . . . . . . . . . . 57.8 mt -120.68 95.08 4.57 Favored 'General case' 0 N--CA 1.447 -0.62 1 N-CA-C 99.827 -4.138 . . . . 0.0 99.827 178.446 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 40' ' ' THR . . . . . . . . . . . . . 4.6 t -48.82 158.83 0.28 Allowed 'General case' 0 N--CA 1.457 -0.102 0 C-N-CA 122.783 0.433 . . . . 0.0 110.358 -178.952 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 41' ' ' VAL . . . . . . . . . . . . . 97.9 t -41.49 -47.9 0.83 Allowed 'Isoleucine or valine' 0 N--CA 1.447 -0.601 0 C-N-CA 124.221 1.008 . . . . 0.0 112.914 -176.828 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 42' ' ' SER . . . . . . . . . . . . . 2.5 p -65.43 -45.75 82.62 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 117.694 -1.603 . . . . 0.0 112.701 -179.403 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -61.02 -45.3 95.37 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 125.346 1.458 . . . . 0.0 110.389 179.225 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 44' ' ' TYR . . . . . . . . . . . . . 9.8 t80 -60.44 -46.29 90.57 Favored 'General case' 0 C--O 1.222 -0.342 0 C-N-CA 123.768 0.827 . . . . 0.0 109.861 179.456 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 45' ' ' ILE . . . . . . . . . . . . . 19.0 mm -57.67 -61.51 1.28 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.355 0 CA-C-N 119.656 1.116 . . . . 0.0 110.228 179.689 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 46' ' ' ARG . . . . . . . . . . . . . 21.7 ptt180 -53.65 -47.51 70.28 Favored 'General case' 0 CA--C 1.528 0.133 0 CA-C-O 119.373 -0.346 . . . . 0.0 111.641 -178.792 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 47' ' ' ASN . . . . . . . . . . . . . 41.9 t30 -64.33 -49.67 70.82 Favored 'General case' 0 C--O 1.234 0.286 0 N-CA-C 114.117 1.154 . . . . 0.0 114.117 -178.989 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -68.1 -21.31 64.97 Favored 'General case' 0 C--O 1.23 0.069 0 C-N-CA 124.19 0.996 . . . . 0.0 112.365 -179.344 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 49' ' ' ALA . . . . . . . . . . . . . . . -87.19 -40.3 14.7 Favored 'General case' 0 N--CA 1.451 -0.404 0 CA-C-N 118.587 0.63 . . . . 0.0 110.975 179.719 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 39.4 mt -68.29 -48.69 64.32 Favored 'General case' 0 C--O 1.233 0.208 0 O-C-N 121.612 -0.68 . . . . 0.0 112.834 -179.055 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 51' ' ' ASN . . . . . . . . . . . . . 44.2 m-80 . . . . . 0 C--O 1.247 0.922 0 CA-C-O 117.445 -1.264 . . . . 0.0 112.565 -177.026 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 3.2 t . . . . . 0 N--CA 1.445 -0.687 0 N-CA-C 107.12 -1.437 . . . . 0.0 107.12 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 3.7 t -131.62 144.3 37.86 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 N-CA-C 106.038 -1.838 . . . . 0.0 106.038 178.435 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 9.4 p -135.61 103.53 4.01 Favored 'Isoleucine or valine' 0 C--O 1.238 0.487 0 N-CA-C 105.931 -1.877 . . . . 0.0 105.931 179.49 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 30.9 ttm180 -139.27 151.09 46.19 Favored 'General case' 0 CA--C 1.514 -0.438 0 CA-C-N 115.005 -0.998 . . . . 0.0 109.516 -179.706 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 19.4 m -103.05 144.6 31.08 Favored 'General case' 0 N--CA 1.449 -0.507 0 N-CA-C 107.344 -1.354 . . . . 0.0 107.344 -179.845 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 54.4 mt -133.32 142.33 48.4 Favored 'General case' 0 C--O 1.236 0.353 0 CA-C-O 121.902 0.858 . . . . 0.0 109.334 179.44 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 10.8 mmt85 -102.18 141.59 34.78 Favored 'General case' 0 N--CA 1.451 -0.389 0 C-N-CA 126.707 2.003 . . . . 0.0 106.809 178.898 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 95.0 m-85 -140.6 143.58 35.33 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 105.418 -2.067 . . . . 0.0 105.418 179.342 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 1.7 m -78.72 165.28 50.61 Favored Pre-proline 0 CA--C 1.539 0.526 0 N-CA-C 108.298 -1.001 . . . . 0.0 108.298 179.851 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -67.5 -21.14 46.86 Favored 'Trans proline' 0 CA--C 1.535 0.539 0 C-N-CA 122.018 1.812 . . . . 0.0 112.107 -179.642 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 16.0 t -82.89 -20.87 9.35 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.409 0 C-N-CA 125.07 1.348 . . . . 0.0 110.687 -179.686 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 93.6 mt-10 -92.61 -46.64 7.5 Favored 'General case' 0 CA--C 1.531 0.23 0 N-CA-C 107.047 -1.464 . . . . 0.0 107.047 178.782 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 2.9 t70 -55.69 -52.7 62.97 Favored 'General case' 0 CA--C 1.507 -0.693 0 C-N-CA 128.601 2.76 . . . . 0.0 112.817 179.792 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -60.99 -38.66 86.79 Favored 'General case' 0 N--CA 1.45 -0.447 0 C-N-CA 119.451 -0.9 . . . . 0.0 110.209 -178.508 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 89.5 m -64.96 -53.01 53.0 Favored 'General case' 0 N--CA 1.451 -0.376 0 CA-C-O 118.83 -0.605 . . . . 0.0 109.628 179.015 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 78.2 mt -56.57 -43.7 79.14 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.203 0 N-CA-C 109.06 -0.718 . . . . 0.0 109.06 -179.708 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 55.2 ttt180 -61.82 -50.6 71.66 Favored 'General case' 0 N--CA 1.455 -0.2 0 C-N-CA 123.734 0.814 . . . . 0.0 110.792 179.402 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 2.4 mptm? -61.86 -46.81 87.84 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-N 118.747 0.703 . . . . 0.0 110.257 -179.101 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 26.0 mmtp -63.74 -45.01 91.83 Favored 'General case' 0 C--O 1.227 -0.124 0 CA-C-N 118.655 0.661 . . . . 0.0 110.322 -179.799 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -60.57 -46.55 89.79 Favored 'General case' 0 C--O 1.237 0.413 0 C-N-CA 123.733 0.813 . . . . 0.0 110.424 179.753 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 27.7 tt0 -67.14 -39.65 86.62 Favored 'General case' 0 N--CA 1.454 -0.263 0 O-C-N 121.849 -0.532 . . . . 0.0 110.815 -179.564 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -67.58 -44.27 78.55 Favored 'General case' 0 N--CA 1.456 -0.168 0 O-C-N 121.747 -0.596 . . . . 0.0 110.347 -179.999 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 6.8 t -69.53 -17.29 63.57 Favored 'General case' 0 N--CA 1.449 -0.516 0 C-N-CA 124.553 1.141 . . . . 0.0 111.764 -178.602 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 75.43 26.42 65.76 Favored Glycine 0 CA--C 1.53 1.001 0 CA-C-N 118.853 0.751 . . . . 0.0 111.353 -179.969 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 88.6 mt -127.78 114.21 16.96 Favored 'General case' 0 N--CA 1.454 -0.233 0 C-N-CA 127.46 2.304 . . . . 0.0 105.517 179.902 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 9.4 t -52.22 154.9 2.16 Favored 'General case' 0 CA--C 1.536 0.421 0 CA-C-N 119.397 0.998 . . . . 0.0 109.664 179.747 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 53.6 t -46.78 -41.95 5.54 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.311 0 C-N-CA 125.407 1.483 . . . . 0.0 112.011 -179.052 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 7.1 p -63.86 -48.84 75.12 Favored 'General case' 0 CA--C 1.541 0.599 0 CA-C-N 119.599 1.09 . . . . 0.0 110.822 179.557 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -62.2 -45.56 92.84 Favored 'General case' 0 C--O 1.223 -0.293 0 C-N-CA 124.837 1.255 . . . . 0.0 109.509 178.621 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 71.6 t80 -54.92 -50.38 68.96 Favored 'General case' 0 N--CA 1.452 -0.351 0 C-N-CA 125.056 1.343 . . . . 0.0 108.802 179.308 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 8.3 mm -56.44 -63.59 0.6 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.316 0 C-N-CA 124.229 1.012 . . . . 0.0 110.505 179.406 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 25.8 ptt180 -55.53 -41.47 73.2 Favored 'General case' 0 N--CA 1.466 0.333 0 O-C-N 121.607 -0.683 . . . . 0.0 111.807 -178.657 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 22.2 t30 -60.81 -53.47 56.93 Favored 'General case' 0 N--CA 1.453 -0.321 0 C-N-CA 123.81 0.844 . . . . 0.0 110.944 179.803 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -63.82 -32.02 73.39 Favored 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 123.532 0.733 . . . . 0.0 112.375 -179.58 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -73.06 -28.73 62.48 Favored 'General case' 0 CA--C 1.531 0.222 0 N-CA-C 113.366 0.876 . . . . 0.0 113.366 -179.317 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 19.2 mt -92.23 -34.74 14.15 Favored 'General case' 0 C--O 1.236 0.381 0 O-C-N 121.912 -0.493 . . . . 0.0 110.758 -179.592 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 28.8 m-80 . . . . . 0 C--O 1.249 1.044 0 C-N-CA 124.438 1.095 . . . . 0.0 108.848 179.896 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 1.9 t . . . . . 0 N--CA 1.444 -0.747 0 N-CA-C 107.717 -1.216 . . . . 0.0 107.717 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 38.9 t -108.38 153.89 9.81 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.687 0 N-CA-C 105.884 -1.895 . . . . 0.0 105.884 178.332 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 9.8 p -150.24 103.48 0.33 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.555 0 N-CA-C 107.826 -1.176 . . . . 0.0 107.826 178.885 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 15.7 ttm180 -146.55 152.75 39.46 Favored 'General case' 0 C--N 1.328 -0.344 0 O-C-N 121.355 -0.84 . . . . 0.0 109.783 -179.932 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 7.1 m -96.72 140.08 31.83 Favored 'General case' 0 N--CA 1.448 -0.529 0 C-N-CA 125.446 1.498 . . . . 0.0 108.169 179.322 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 95.0 mt -123.06 165.73 16.31 Favored 'General case' 0 C--O 1.236 0.38 0 N-CA-C 106.965 -1.494 . . . . 0.0 106.965 178.213 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 1.9 mmt85 -125.22 143.92 50.71 Favored 'General case' 0 C--O 1.239 0.525 0 C-N-CA 126.565 1.946 . . . . 0.0 108.34 179.531 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 22' ' ' PHE . . . . . . . . . . . . . 97.4 m-85 -141.41 141.9 33.74 Favored 'General case' 0 CA--C 1.516 -0.347 0 N-CA-C 105.407 -2.071 . . . . 0.0 105.407 179.75 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 4.9 m -79.75 165.0 50.47 Favored Pre-proline 0 C--N 1.324 -0.531 0 CA-C-O 118.432 -0.794 . . . . 0.0 109.171 -179.482 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 24' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -67.27 -5.32 13.55 Favored 'Trans proline' 0 CA--C 1.537 0.645 0 C-N-CA 122.9 2.4 . . . . 0.0 113.165 179.811 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 25' ' ' VAL . . . . . . . . . . . . . 55.4 t -93.85 -61.75 1.99 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.487 0 N-CA-C 104.934 -2.247 . . . . 0.0 104.934 178.713 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 63.6 mt-10 -53.84 -48.12 70.28 Favored 'General case' 0 N--CA 1.455 -0.217 0 C-N-CA 126.186 1.795 . . . . 0.0 110.961 -179.528 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 27' ' ' ASP . . . . . . . . . . . . . 15.5 t70 -61.25 -50.68 72.08 Favored 'General case' 0 CA--C 1.511 -0.526 0 C-N-CA 124.81 1.244 . . . . 0.0 112.048 -179.841 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 28' ' ' GLU . . . . . . . . . . . . . 5.4 tp10 -60.26 -43.57 96.04 Favored 'General case' 0 N--CA 1.449 -0.478 0 N-CA-C 108.645 -0.872 . . . . 0.0 108.645 -179.318 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 53.4 m -59.37 -54.36 47.59 Favored 'General case' 0 N--CA 1.452 -0.339 0 N-CA-C 108.731 -0.84 . . . . 0.0 108.731 178.902 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 71.3 mt -58.53 -43.96 88.15 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.317 0 C-N-CA 123.194 0.597 . . . . 0.0 110.191 -179.524 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 31.5 ttt180 -56.3 -49.44 74.29 Favored 'General case' 0 C--N 1.333 -0.147 0 C-N-CA 123.929 0.891 . . . . 0.0 109.624 179.711 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 1.4 mptm? -67.4 -43.07 82.21 Favored 'General case' 0 C--O 1.223 -0.309 0 CA-C-O 117.758 -1.115 . . . . 0.0 110.757 -179.572 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 29.3 mmtp -63.11 -44.14 96.49 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-N 119.842 1.201 . . . . 0.0 110.665 -179.559 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 34' ' ' ALA . . . . . . . . . . . . . . . -59.32 -56.6 20.02 Favored 'General case' 0 N--CA 1.451 -0.423 0 C-N-CA 124.8 1.24 . . . . 0.0 109.158 179.63 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -61.77 -37.94 86.18 Favored 'General case' 0 C--O 1.236 0.364 0 C-N-CA 123.389 0.676 . . . . 0.0 112.024 -178.688 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 36' ' ' ASP . . . . . . . . . . . . . 9.3 t70 -64.54 -40.7 96.08 Favored 'General case' 0 C--N 1.332 -0.153 0 C-N-CA 125.337 1.455 . . . . 0.0 108.655 178.785 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 37' ' ' SER . . . . . . . . . . . . . 6.2 t -77.78 -8.36 57.9 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 123.738 0.815 . . . . 0.0 110.453 179.013 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 69.45 24.17 76.22 Favored Glycine 0 CA--C 1.531 1.041 0 O-C-N 121.053 -1.029 . . . . 0.0 110.733 -178.991 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 39' ' ' LEU . . . . . . . . . . . . . 71.7 mt -115.99 128.07 55.44 Favored 'General case' 0 N--CA 1.447 -0.595 0 C-N-CA 126.313 1.845 . . . . 0.0 107.399 -179.239 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 40' ' ' THR . . . . . . . . . . . . . 3.5 t -57.31 145.28 32.69 Favored 'General case' 0 CA--C 1.538 0.51 0 N-CA-C 106.717 -1.586 . . . . 0.0 106.717 177.747 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 41' ' ' VAL . . . . . . . . . . . . . 94.1 t -49.8 -41.09 16.63 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.28 0 O-C-N 120.772 -1.205 . . . . 0.0 112.106 -178.735 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 42' ' ' SER . . . . . . . . . . . . . 11.3 m -61.64 -40.75 96.0 Favored 'General case' 0 CA--C 1.541 0.61 0 CA-C-N 119.768 1.167 . . . . 0.0 111.373 -179.648 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -68.59 -44.09 75.08 Favored 'General case' 0 C--O 1.22 -0.477 0 C-N-CA 124.389 1.076 . . . . 0.0 108.097 178.13 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 44' ' ' TYR . . . . . . . . . . . . . 70.6 t80 -55.22 -51.99 64.81 Favored 'General case' 0 N--CA 1.454 -0.254 0 N-CA-C 108.726 -0.842 . . . . 0.0 108.726 179.393 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 45' ' ' ILE . . . . . . . . . . . . . 19.3 mm -53.24 -64.65 0.38 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.23 0 C-N-CA 124.328 1.051 . . . . 0.0 111.47 179.545 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 46' ' ' ARG . . . . . . . . . . . . . 27.1 ptt180 -58.11 -42.06 84.92 Favored 'General case' 0 C--O 1.223 -0.331 0 CA-C-O 118.745 -0.645 . . . . 0.0 111.716 -177.978 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 47' ' ' ASN . . . . . . . . . . . . . 43.8 t30 -60.92 -54.84 40.16 Favored 'General case' 0 N--CA 1.45 -0.474 0 CA-C-O 118.655 -0.688 . . . . 0.0 110.216 -179.72 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -58.78 -31.31 68.27 Favored 'General case' 0 CA--C 1.53 0.201 0 C-N-CA 124.03 0.932 . . . . 0.0 111.56 -179.783 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 49' ' ' ALA . . . . . . . . . . . . . . . -74.86 -20.89 59.55 Favored 'General case' 0 N--CA 1.454 -0.273 0 N-CA-C 113.267 0.84 . . . . 0.0 113.267 -179.708 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 11.8 mt -107.91 -29.02 9.27 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 119.417 1.008 . . . . 0.0 111.592 -179.41 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 51' ' ' ASN . . . . . . . . . . . . . 73.0 m-20 . . . . . 0 C--O 1.245 0.855 0 C-N-CA 126.41 1.884 . . . . 0.0 109.817 -178.99 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 4.3 t . . . . . 0 N--CA 1.445 -0.691 0 CA-C-O 121.466 0.65 . . . . 0.0 109.409 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 1.4 t -125.62 102.76 10.8 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.457 0 C-N-CA 123.562 0.745 . . . . 0.0 110.187 -177.9 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 3.1 p -101.25 127.51 54.45 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.412 0 C-N-CA 124.133 0.973 . . . . 0.0 110.872 -178.035 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 14.8 ttm180 -154.66 160.92 41.71 Favored 'General case' 0 C--O 1.237 0.399 0 N-CA-C 108.771 -0.826 . . . . 0.0 108.771 178.045 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 7.1 m -90.76 91.61 8.45 Favored 'General case' 0 C--O 1.237 0.401 0 N-CA-C 107.473 -1.306 . . . . 0.0 107.473 179.565 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -97.84 100.78 12.15 Favored 'General case' 0 C--O 1.236 0.393 0 N-CA-C 107.568 -1.271 . . . . 0.0 107.568 179.147 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 32.9 mtt180 -87.57 159.03 18.75 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 108.992 -0.744 . . . . 0.0 108.992 179.585 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 86.0 m-85 -136.58 152.02 50.01 Favored 'General case' 0 CA--C 1.511 -0.535 0 N-CA-C 108.151 -1.055 . . . . 0.0 108.151 -179.765 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -82.88 171.83 10.84 Favored Pre-proline 0 CA--C 1.539 0.525 0 N-CA-C 107.48 -1.304 . . . . 0.0 107.48 179.664 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -67.24 -37.26 18.68 Favored 'Trans proline' 0 N--CA 1.457 -0.66 0 C-N-CA 121.483 1.455 . . . . 0.0 112.712 -178.473 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 92.3 t -66.58 -53.06 39.2 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.324 0 N-CA-C 107.825 -1.176 . . . . 0.0 107.825 179.508 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 -57.84 -47.24 83.25 Favored 'General case' 0 N--CA 1.455 -0.182 0 C-N-CA 122.941 0.496 . . . . 0.0 110.443 179.576 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 21.7 t70 -59.54 -52.27 66.29 Favored 'General case' 0 CA--C 1.507 -0.676 0 C-N-CA 123.147 0.579 . . . . 0.0 111.257 -179.979 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -56.1 -38.54 70.89 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 118.351 0.523 . . . . 0.0 110.594 -179.456 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 25.9 m -67.05 -56.48 9.9 Favored 'General case' 0 N--CA 1.449 -0.495 0 C-N-CA 123.359 0.664 . . . . 0.0 109.874 179.527 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 88.2 mt -60.16 -38.89 78.85 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.252 0 C-N-CA 123.834 0.854 . . . . 0.0 109.758 -179.394 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 64.4 ttt180 -61.86 -51.72 67.05 Favored 'General case' 0 C--O 1.223 -0.293 0 C-N-CA 124.857 1.263 . . . . 0.0 108.341 179.217 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 2.6 mptp? -59.42 -48.97 79.61 Favored 'General case' 0 CA--C 1.515 -0.381 0 C-N-CA 123.305 0.642 . . . . 0.0 109.529 179.78 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 64.4 mmtt -60.88 -45.72 93.47 Favored 'General case' 0 CA--C 1.509 -0.626 0 CA-C-O 118.565 -0.731 . . . . 0.0 111.871 -178.943 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -63.41 -53.71 48.12 Favored 'General case' 0 N--CA 1.446 -0.665 0 O-C-N 123.595 0.559 . . . . 0.0 110.161 -179.256 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -61.13 -36.88 80.91 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 123.378 0.671 . . . . 0.0 111.824 -177.866 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -73.41 -33.77 65.13 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 125.331 1.452 . . . . 0.0 109.696 178.752 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 30.0 t -72.71 -13.69 61.4 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 125.079 1.352 . . . . 0.0 108.09 177.55 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 82.95 -9.88 59.06 Favored Glycine 0 C--N 1.338 0.694 0 C-N-CA 125.639 1.59 . . . . 0.0 111.784 -179.01 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 82.6 mt -86.3 173.25 9.86 Favored 'General case' 0 N--CA 1.439 -0.98 0 C-N-CA 126.0 1.72 . . . . 0.0 107.222 179.745 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -96.51 157.09 16.06 Favored 'General case' 0 C--N 1.317 -0.844 0 N-CA-C 104.548 -2.389 . . . . 0.0 104.548 177.362 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 84.3 t -51.01 -40.9 21.51 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.382 0 C-N-CA 123.635 0.774 . . . . 0.0 109.503 178.731 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 10.5 p -60.99 -45.05 96.35 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-N 120.428 1.467 . . . . 0.0 112.012 -179.652 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -66.68 -48.39 69.47 Favored 'General case' 0 C--O 1.225 -0.185 0 C-N-CA 123.973 0.909 . . . . 0.0 109.523 179.104 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 87.9 t80 -56.52 -47.13 80.01 Favored 'General case' 0 CA--C 1.538 0.503 0 N-CA-C 109.584 -0.524 . . . . 0.0 109.584 179.819 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 5.9 mm -54.58 -64.45 0.44 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.357 0 C-N-CA 124.896 1.278 . . . . 0.0 110.592 179.477 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 13.1 ptm180 -56.08 -45.06 79.49 Favored 'General case' 0 C--O 1.219 -0.5 0 CA-C-O 118.97 -0.538 . . . . 0.0 110.889 -178.744 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 43.0 t30 -59.28 -54.91 41.45 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-N 118.405 0.548 . . . . 0.0 111.901 -179.299 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -61.81 -29.93 70.48 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 123.813 0.845 . . . . 0.0 111.596 -179.603 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -75.0 -23.06 58.18 Favored 'General case' 0 C--O 1.223 -0.291 0 N-CA-C 113.615 0.969 . . . . 0.0 113.615 179.84 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 6.9 mt -99.93 -39.1 8.33 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 119.62 1.1 . . . . 0.0 112.174 -178.643 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 22.0 m-80 . . . . . 0 C--O 1.254 1.325 0 CA-C-O 116.329 -1.796 . . . . 0.0 113.187 -178.817 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 4.6 t . . . . . 0 N--CA 1.449 -0.505 0 N-CA-C 108.202 -1.036 . . . . 0.0 108.202 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 24.7 t -116.28 148.18 19.17 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.504 0 N-CA-C 106.524 -1.658 . . . . 0.0 106.524 179.146 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 10.7 p -141.25 106.26 1.7 Allowed 'Isoleucine or valine' 0 N--CA 1.447 -0.614 0 N-CA-C 107.299 -1.371 . . . . 0.0 107.299 177.644 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 33.0 ttm180 -136.51 159.74 40.88 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.32 -0.855 . . . . 0.0 109.228 179.911 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 11.6 m -97.38 87.62 4.19 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 107.42 -1.326 . . . . 0.0 107.42 -179.78 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -81.82 105.49 12.99 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 108.812 -0.81 . . . . 0.0 108.812 -179.806 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 10.1 mtm180 -93.7 142.28 27.54 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 126.56 1.944 . . . . 0.0 110.918 -179.885 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 22' ' ' PHE . . . . . . . . . . . . . 78.0 m-85 -129.56 170.52 13.65 Favored 'General case' 0 N--CA 1.482 1.128 0 C-N-CA 125.192 1.397 . . . . 0.0 111.365 -179.15 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 2.0 m -99.09 166.03 13.78 Favored Pre-proline 0 CA--C 1.538 0.483 0 N-CA-C 108.04 -1.096 . . . . 0.0 108.04 178.809 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 24' ' ' PRO . . . . . . . . . . . . . 70.6 Cg_endo -69.16 -28.43 28.15 Favored 'Trans proline' 0 N--CA 1.458 -0.561 0 C-N-CA 121.442 1.428 . . . . 0.0 112.398 -179.72 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 25' ' ' VAL . . . . . . . . . . . . . 96.1 t -67.51 -56.75 12.12 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.31 0 N-CA-C 106.751 -1.574 . . . . 0.0 106.751 179.249 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 1.4 mp0 -56.44 -44.05 80.09 Favored 'General case' 0 CA--C 1.528 0.114 0 C-N-CA 124.92 1.288 . . . . 0.0 111.432 179.53 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 27' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -62.78 -37.53 87.05 Favored 'General case' 0 CA--C 1.517 -0.3 0 N-CA-C 113.131 0.789 . . . . 0.0 113.131 -179.628 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 28' ' ' GLU . . . . . . . . . . . . . 32.3 tt0 -61.62 -50.82 71.0 Favored 'General case' 0 N--CA 1.45 -0.439 0 N-CA-C 107.141 -1.429 . . . . 0.0 107.141 178.963 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 30.3 m -58.83 -59.22 5.78 Favored 'General case' 0 N--CA 1.451 -0.395 0 C-N-CA 124.489 1.116 . . . . 0.0 111.279 -179.473 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 74.9 mt -56.67 -46.12 82.83 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.22 0 C-N-CA 124.45 1.1 . . . . 0.0 110.24 -178.78 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 56.4 ttt180 -62.22 -45.45 93.3 Favored 'General case' 0 CA--C 1.518 -0.279 0 CA-C-N 119.288 0.949 . . . . 0.0 111.255 -179.499 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 4.9 mptp? -60.05 -51.37 69.91 Favored 'General case' 0 CA--C 1.515 -0.397 0 N-CA-C 109.802 -0.444 . . . . 0.0 109.802 -179.059 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 37.2 mmtt -60.27 -52.99 62.92 Favored 'General case' 0 N--CA 1.449 -0.512 0 O-C-N 124.431 1.082 . . . . 0.0 111.022 -179.035 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 34' ' ' ALA . . . . . . . . . . . . . . . -55.94 -54.05 49.42 Favored 'General case' 0 N--CA 1.45 -0.467 0 C-N-CA 123.674 0.79 . . . . 0.0 111.318 -178.818 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 24.6 tt0 -63.16 -42.77 99.47 Favored 'General case' 0 N--CA 1.451 -0.406 0 N-CA-C 112.588 0.588 . . . . 0.0 112.588 -178.094 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 36' ' ' ASP . . . . . . . . . . . . . 26.9 t70 -65.64 -36.9 85.02 Favored 'General case' 0 C--O 1.232 0.143 0 C-N-CA 123.586 0.754 . . . . 0.0 110.502 -179.888 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 37' ' ' SER . . . . . . . . . . . . . 12.4 t -78.83 -7.25 57.7 Favored 'General case' 0 N--CA 1.446 -0.629 0 C-N-CA 123.995 0.918 . . . . 0.0 110.819 179.261 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 70.62 10.34 66.92 Favored Glycine 0 CA--C 1.536 1.346 0 CA-C-N 119.732 1.151 . . . . 0.0 113.28 -179.616 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 39' ' ' LEU . . . . . . . . . . . . . 15.2 mt -108.92 107.56 17.99 Favored 'General case' 0 N--CA 1.451 -0.382 0 N-CA-C 103.961 -2.607 . . . . 0.0 103.961 179.475 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 40' ' ' THR . . . . . . . . . . . . . 13.5 t -46.74 151.66 0.57 Allowed 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 123.808 0.843 . . . . 0.0 109.969 179.582 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 41' ' ' VAL . . . . . . . . . . . . . 58.8 t -43.62 -43.14 1.64 Allowed 'Isoleucine or valine' 0 CA--C 1.527 0.07 0 C-N-CA 125.441 1.496 . . . . 0.0 111.902 -178.109 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 42' ' ' SER . . . . . . . . . . . . . 5.4 p -66.55 -43.64 84.52 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-N 119.588 1.085 . . . . 0.0 112.747 179.458 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.72 -40.76 97.55 Favored 'General case' 0 C--O 1.232 0.137 0 N-CA-C 109.175 -0.676 . . . . 0.0 109.175 178.583 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 44' ' ' TYR . . . . . . . . . . . . . 64.3 t80 -60.6 -53.31 59.04 Favored 'General case' 0 N--CA 1.442 -0.841 0 N-CA-C 107.975 -1.12 . . . . 0.0 107.975 179.146 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 45' ' ' ILE . . . . . . . . . . . . . 19.7 mm -55.04 -54.46 23.85 Favored 'Isoleucine or valine' 0 C--N 1.341 0.231 0 C-N-CA 123.387 0.675 . . . . 0.0 109.285 179.521 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 46' ' ' ARG . . . . . . . . . . . . . 1.1 mtp180 -47.29 -64.59 0.74 Allowed 'General case' 0 C--O 1.22 -0.465 0 C-N-CA 124.138 0.975 . . . . 0.0 109.902 179.43 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 47' ' ' ASN . . . . . . . . . . . . . 27.4 t30 -54.19 -51.15 65.3 Favored 'General case' 0 C--N 1.325 -0.499 0 C-N-CA 126.583 1.953 . . . . 0.0 113.763 -177.944 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -60.39 -29.28 68.84 Favored 'General case' 0 N--CA 1.453 -0.324 0 C-N-CA 122.997 0.519 . . . . 0.0 112.362 -179.062 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 49' ' ' ALA . . . . . . . . . . . . . . . -86.41 -12.42 49.21 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 113.675 0.991 . . . . 0.0 113.675 -179.306 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 11.2 mt -104.86 -29.09 10.73 Favored 'General case' 0 CA--C 1.516 -0.353 0 O-C-N 121.213 -0.929 . . . . 0.0 111.154 -178.932 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 51' ' ' ASN . . . . . . . . . . . . . 74.4 m-80 . . . . . 0 C--O 1.249 1.04 0 C-N-CA 125.337 1.455 . . . . 0.0 111.298 -179.057 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 3.1 t . . . . . 0 N--CA 1.451 -0.391 0 N-CA-C 107.691 -1.226 . . . . 0.0 107.691 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 2.5 t -107.29 145.87 14.18 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.764 0 N-CA-C 106.552 -1.648 . . . . 0.0 106.552 179.142 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 14.5 p -140.69 110.26 3.24 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.765 0 N-CA-C 105.209 -2.145 . . . . 0.0 105.209 178.298 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 21.6 ttt85 -144.72 -175.86 4.83 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 109.348 -0.612 . . . . 0.0 109.348 -178.945 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 13.4 m -119.35 112.43 19.42 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-N 118.82 0.737 . . . . 0.0 110.519 -179.107 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -105.56 100.74 10.3 Favored 'General case' 0 C--O 1.236 0.344 0 C-N-CA 125.788 1.635 . . . . 0.0 107.64 179.788 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 6.1 mtt180 -84.97 157.46 20.79 Favored 'General case' 0 C--O 1.234 0.239 0 N-CA-C 108.437 -0.949 . . . . 0.0 108.437 177.937 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 92.7 m-85 -140.24 152.54 46.03 Favored 'General case' 0 C--O 1.236 0.359 0 N-CA-C 107.38 -1.341 . . . . 0.0 107.38 179.629 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 1.5 m -83.06 171.59 11.34 Favored Pre-proline 0 CA--C 1.547 0.832 0 CA-C-O 117.772 -1.109 . . . . 0.0 108.233 179.602 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_endo -63.75 -48.44 5.48 Favored 'Trans proline' 0 C--N 1.347 0.497 0 C-N-CA 122.025 1.817 . . . . 0.0 114.713 -177.417 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 93.9 t -64.63 -37.96 81.42 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.337 0 C-N-CA 124.787 1.235 . . . . 0.0 110.375 -179.603 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -64.33 -53.48 48.14 Favored 'General case' 0 N--CA 1.454 -0.264 0 C-N-CA 125.526 1.53 . . . . 0.0 108.043 -179.576 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 3.5 t70 -60.24 -42.91 96.27 Favored 'General case' 0 C--N 1.331 -0.204 0 C-N-CA 127.479 2.312 . . . . 0.0 111.425 179.583 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 88.7 tt0 -63.88 -49.39 72.89 Favored 'General case' 0 N--CA 1.45 -0.434 0 N-CA-C 108.018 -1.105 . . . . 0.0 108.018 179.135 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 91.2 m -58.54 -49.78 76.17 Favored 'General case' 0 CA--C 1.533 0.325 0 N-CA-C 109.169 -0.678 . . . . 0.0 109.169 179.274 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 34.0 mt -58.07 -46.34 88.15 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.303 0 C-N-CA 123.307 0.643 . . . . 0.0 109.38 179.54 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 29.1 ttt180 -60.36 -51.19 70.55 Favored 'General case' 0 CA--C 1.518 -0.284 0 CA-C-N 118.784 0.72 . . . . 0.0 110.839 -179.626 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 1.7 mptm? -61.85 -44.9 95.9 Favored 'General case' 0 CA--C 1.52 -0.21 0 CA-C-O 118.547 -0.74 . . . . 0.0 109.691 -179.092 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 38.4 tptt -64.57 -38.97 92.83 Favored 'General case' 0 C--O 1.224 -0.255 0 CA-C-N 118.905 0.775 . . . . 0.0 110.694 -179.614 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -63.46 -54.67 32.82 Favored 'General case' 0 C--O 1.234 0.263 0 C-N-CA 125.258 1.423 . . . . 0.0 108.578 178.839 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 7.4 tp10 -59.16 -40.05 84.4 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 124.324 1.049 . . . . 0.0 110.48 -179.364 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -71.38 -37.24 71.59 Favored 'General case' 0 CA--C 1.53 0.199 0 C-N-CA 125.751 1.62 . . . . 0.0 111.713 179.704 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 22.7 t -76.67 -15.63 59.75 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 124.441 1.096 . . . . 0.0 111.393 179.784 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 77.54 34.43 39.91 Favored Glycine 0 CA--C 1.53 0.97 0 N-CA-C 110.017 -1.233 . . . . 0.0 110.017 -179.121 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 90.8 mt -136.49 132.69 35.66 Favored 'General case' 0 CA--C 1.514 -0.424 0 N-CA-C 106.735 -1.58 . . . . 0.0 106.735 179.792 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 6.7 t -62.68 150.91 39.77 Favored 'General case' 0 CA--C 1.537 0.471 0 N-CA-C 107.544 -1.28 . . . . 0.0 107.544 178.616 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 41.7 t -47.09 -45.13 8.3 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.446 0 C-N-CA 125.025 1.33 . . . . 0.0 111.513 -179.752 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 56.7 p -56.73 -45.5 81.9 Favored 'General case' 0 CA--C 1.535 0.39 0 CA-C-N 119.029 0.831 . . . . 0.0 111.922 -179.625 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -71.72 -44.33 64.34 Favored 'General case' 0 N--CA 1.449 -0.48 0 C-N-CA 124.369 1.068 . . . . 0.0 109.5 179.104 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 93.2 t80 -52.1 -48.75 64.6 Favored 'General case' 0 CA--C 1.53 0.182 0 C-N-CA 124.519 1.128 . . . . 0.0 109.196 179.79 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 24.2 mm -55.74 -66.61 0.27 Allowed 'Isoleucine or valine' 0 C--O 1.226 -0.143 0 C-N-CA 123.918 0.887 . . . . 0.0 111.411 179.626 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 15.7 ptt180 -58.54 -45.39 89.0 Favored 'General case' 0 C--O 1.219 -0.516 0 CA-C-O 118.398 -0.81 . . . . 0.0 112.001 -177.811 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 16.6 t30 -55.34 -47.72 75.27 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 119.153 0.888 . . . . 0.0 111.451 -179.41 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -67.51 -30.9 70.69 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 122.823 0.449 . . . . 0.0 111.896 179.452 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -77.58 -29.01 51.87 Favored 'General case' 0 N--CA 1.451 -0.418 0 C-N-CA 124.245 1.018 . . . . 0.0 113.432 -179.65 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 8.9 mt -89.23 -39.52 13.47 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 113.279 0.844 . . . . 0.0 113.279 -178.33 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 65.7 m-20 . . . . . 0 C--O 1.251 1.181 0 C-N-CA 123.566 0.746 . . . . 0.0 112.657 -178.446 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 4.3 t . . . . . 0 N--CA 1.449 -0.5 0 N-CA-C 108.059 -1.089 . . . . 0.0 108.059 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 5.8 t -107.18 157.07 7.45 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 N-CA-C 106.34 -1.726 . . . . 0.0 106.34 178.405 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 10.9 p -151.21 120.4 0.87 Allowed 'Isoleucine or valine' 0 N--CA 1.444 -0.76 0 N-CA-C 105.017 -2.216 . . . . 0.0 105.017 178.585 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 4.9 ttt85 -145.96 175.67 10.27 Favored 'General case' 0 C--O 1.238 0.457 0 C-N-CA 119.646 -0.822 . . . . 0.0 111.702 -179.845 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 20.9 m -115.27 76.67 1.01 Allowed 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 106.708 -1.59 . . . . 0.0 106.708 -179.631 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 52.6 tp -89.52 93.16 9.39 Favored 'General case' 0 N--CA 1.448 -0.558 0 C-N-CA 127.362 2.265 . . . . 0.0 107.935 -179.212 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 41.2 mtt180 -76.89 164.56 25.69 Favored 'General case' 0 C--N 1.326 -0.44 0 C-N-CA 123.715 0.806 . . . . 0.0 110.963 -179.728 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 22' ' ' PHE . . . . . . . . . . . . . 69.3 m-85 -142.47 148.56 37.91 Favored 'General case' 0 C--O 1.237 0.395 0 N-CA-C 107.57 -1.27 . . . . 0.0 107.57 179.849 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 49.3 m -79.62 166.12 43.25 Favored Pre-proline 0 CA--C 1.541 0.612 0 N-CA-C 107.771 -1.196 . . . . 0.0 107.771 179.33 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 24' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -64.73 -35.43 46.21 Favored 'Trans proline' 0 C--N 1.348 0.517 0 C-N-CA 121.517 1.478 . . . . 0.0 112.118 -178.696 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 25' ' ' VAL . . . . . . . . . . . . . 89.4 t -60.62 -55.25 25.71 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.375 0 N-CA-C 108.219 -1.03 . . . . 0.0 108.219 179.392 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 4.2 mm-40 -59.92 -44.48 94.3 Favored 'General case' 0 CA--C 1.53 0.206 0 C-N-CA 125.338 1.455 . . . . 0.0 111.109 -178.977 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 27' ' ' ASP . . . . . . . . . . . . . 13.5 t70 -60.97 -46.08 92.17 Favored 'General case' 0 CA--C 1.514 -0.407 0 C-N-CA 125.64 1.576 . . . . 0.0 111.234 179.828 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 28' ' ' GLU . . . . . . . . . . . . . 87.6 tt0 -60.51 -48.18 82.9 Favored 'General case' 0 N--CA 1.448 -0.534 0 N-CA-C 108.387 -0.968 . . . . 0.0 108.387 179.098 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 39.2 m -57.02 -58.08 9.74 Favored 'General case' 0 CA--C 1.536 0.414 0 N-CA-C 109.449 -0.575 . . . . 0.0 109.449 179.522 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 63.4 mt -57.67 -44.02 84.75 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.314 0 C-N-CA 124.456 1.103 . . . . 0.0 111.093 -178.761 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 20.4 ttt180 -61.94 -49.55 75.69 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 119.133 0.879 . . . . 0.0 110.508 179.889 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 1.2 mptm? -62.75 -44.24 96.72 Favored 'General case' 0 CA--C 1.518 -0.252 0 O-C-N 123.463 0.477 . . . . 0.0 110.033 -178.102 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 36.3 tptt -67.94 -43.41 79.16 Favored 'General case' 0 C--O 1.221 -0.436 0 CA-C-O 118.714 -0.66 . . . . 0.0 111.155 -179.584 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 34' ' ' ALA . . . . . . . . . . . . . . . -57.64 -52.29 66.04 Favored 'General case' 0 C--N 1.329 -0.286 0 C-N-CA 124.029 0.932 . . . . 0.0 110.646 179.819 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 31.1 tp10 -63.36 -37.51 87.55 Favored 'General case' 0 CA--C 1.534 0.331 0 N-CA-C 110.46 -0.2 . . . . 0.0 110.46 -178.841 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 36' ' ' ASP . . . . . . . . . . . . . 34.8 t70 -69.28 -41.34 76.98 Favored 'General case' 0 C--O 1.232 0.156 0 C-N-CA 124.419 1.088 . . . . 0.0 111.038 179.741 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 37' ' ' SER . . . . . . . . . . . . . 1.4 t -70.16 -27.17 64.32 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 124.253 1.021 . . . . 0.0 108.886 179.23 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 85.71 22.4 50.26 Favored Glycine 0 CA--C 1.53 1.007 0 N-CA-C 109.959 -1.257 . . . . 0.0 109.959 -178.933 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 39' ' ' LEU . . . . . . . . . . . . . 86.9 mt -122.99 115.0 21.17 Favored 'General case' 0 CA--C 1.508 -0.661 0 N-CA-C 104.034 -2.58 . . . . 0.0 104.034 -179.823 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 40' ' ' THR . . . . . . . . . . . . . 9.0 t -51.9 158.57 1.01 Allowed 'General case' 0 CA--C 1.534 0.345 0 N-CA-C 109.741 -0.466 . . . . 0.0 109.741 179.299 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 41' ' ' VAL . . . . . . . . . . . . . 94.4 t -46.64 -42.11 5.38 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.294 0 C-N-CA 124.201 1.0 . . . . 0.0 112.086 -178.899 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 42' ' ' SER . . . . . . . . . . . . . 19.4 p -64.33 -46.79 81.96 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-N 120.516 1.507 . . . . 0.0 112.109 179.704 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.61 -46.46 85.64 Favored 'General case' 0 C--O 1.222 -0.389 0 C-N-CA 124.23 1.012 . . . . 0.0 108.721 179.119 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 44' ' ' TYR . . . . . . . . . . . . . 82.7 t80 -55.07 -52.98 61.52 Favored 'General case' 0 N--CA 1.447 -0.576 0 C-N-CA 124.399 1.08 . . . . 0.0 109.081 179.426 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 45' ' ' ILE . . . . . . . . . . . . . 11.0 mm -55.89 -62.25 0.89 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.25 0 C-N-CA 124.688 1.195 . . . . 0.0 111.504 179.781 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 46' ' ' ARG . . . . . . . . . . . . . 22.4 ptt180 -58.67 -39.27 80.15 Favored 'General case' 0 N--CA 1.454 -0.262 0 CA-C-O 117.809 -1.091 . . . . 0.0 112.847 -177.69 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 47' ' ' ASN . . . . . . . . . . . . . 29.2 t30 -65.12 -56.01 15.44 Favored 'General case' 0 C--N 1.332 -0.162 0 C-N-CA 124.255 1.022 . . . . 0.0 109.409 179.212 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -56.9 -29.27 62.86 Favored 'General case' 0 N--CA 1.454 -0.274 0 C-N-CA 124.453 1.101 . . . . 0.0 112.055 -179.385 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 49' ' ' ALA . . . . . . . . . . . . . . . -75.08 -25.6 58.69 Favored 'General case' 0 N--CA 1.445 -0.714 0 N-CA-C 113.748 1.018 . . . . 0.0 113.748 179.982 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 10.7 mt -93.72 -44.79 7.98 Favored 'General case' 0 C--O 1.238 0.461 0 C-N-CA 123.373 0.669 . . . . 0.0 109.226 -179.847 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 51' ' ' ASN . . . . . . . . . . . . . 73.0 m-20 . . . . . 0 C--O 1.251 1.132 0 C-N-CA 125.558 1.543 . . . . 0.0 109.99 -179.751 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 2.8 t . . . . . 0 N--CA 1.446 -0.673 0 N-CA-C 108.253 -1.017 . . . . 0.0 108.253 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 6.2 t -132.48 148.74 31.78 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.657 0 N-CA-C 105.65 -1.982 . . . . 0.0 105.65 178.963 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 14.8 p -139.1 112.96 6.92 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.038 0 N-CA-C 105.815 -1.92 . . . . 0.0 105.815 178.02 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 17.7 ttt180 -140.93 178.81 7.1 Favored 'General case' 0 C--O 1.236 0.388 0 N-CA-C 107.549 -1.278 . . . . 0.0 107.549 -179.635 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 6.4 m -116.77 108.03 15.38 Favored 'General case' 0 C--O 1.237 0.414 0 N-CA-C 106.91 -1.515 . . . . 0.0 106.91 179.765 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -96.49 99.77 11.41 Favored 'General case' 0 C--O 1.235 0.308 0 N-CA-C 108.435 -0.95 . . . . 0.0 108.435 -178.94 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 1.2 mmt-85 -81.65 154.9 25.88 Favored 'General case' 0 C--O 1.235 0.316 0 C-N-CA 123.36 0.664 . . . . 0.0 109.484 179.094 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 96.9 m-85 -148.05 152.84 38.07 Favored 'General case' 0 CA--C 1.516 -0.344 0 C-N-CA 124.206 1.002 . . . . 0.0 108.644 178.633 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 14.5 m -79.49 167.04 37.25 Favored Pre-proline 0 CA--C 1.545 0.76 0 N-CA-C 107.496 -1.298 . . . . 0.0 107.496 178.603 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 34.5 Cg_endo -63.38 -43.01 19.41 Favored 'Trans proline' 0 N--CA 1.461 -0.418 0 C-N-CA 121.515 1.477 . . . . 0.0 112.025 -178.713 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 60.7 t -66.49 -39.36 83.81 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.557 0 C-N-CA 124.198 0.999 . . . . 0.0 109.921 179.795 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 97.5 mt-10 -63.7 -41.45 98.12 Favored 'General case' 0 N--CA 1.465 0.279 0 O-C-N 121.209 -0.932 . . . . 0.0 109.731 179.707 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -68.19 -47.51 67.74 Favored 'General case' 0 C--O 1.218 -0.595 0 C-N-CA 124.445 1.098 . . . . 0.0 110.719 179.442 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -58.01 -34.26 69.83 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 118.692 0.678 . . . . 0.0 109.268 178.794 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 39.5 m -70.88 -60.71 2.09 Favored 'General case' 0 N--CA 1.45 -0.433 0 O-C-N 121.795 -0.566 . . . . 0.0 109.614 179.309 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 51.0 mt -58.73 -42.6 85.74 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.295 0 C-N-CA 123.765 0.826 . . . . 0.0 111.814 -178.247 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 59.7 ttt180 -64.27 -44.83 90.5 Favored 'General case' 0 N--CA 1.448 -0.538 0 CA-C-O 117.336 -1.316 . . . . 0.0 110.539 -179.481 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 2.1 mptp? -68.03 -44.73 75.8 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-N 119.863 1.211 . . . . 0.0 109.282 179.536 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 37.0 mmtt -55.93 -49.17 74.24 Favored 'General case' 0 CA--C 1.518 -0.253 0 C-N-CA 123.686 0.795 . . . . 0.0 110.609 -179.779 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -59.41 -53.8 54.05 Favored 'General case' 0 N--CA 1.444 -0.76 0 C-N-CA 125.419 1.487 . . . . 0.0 110.264 179.897 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 25.7 tt0 -57.76 -41.26 81.58 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 123.761 0.824 . . . . 0.0 110.805 -179.498 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 29.2 t70 -68.34 -40.24 81.61 Favored 'General case' 0 N--CA 1.463 0.201 0 C-N-CA 125.452 1.501 . . . . 0.0 109.95 179.663 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 22.5 t -73.06 -15.39 61.51 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 123.817 0.847 . . . . 0.0 109.647 178.356 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 75.21 0.82 62.34 Favored Glycine 0 CA--C 1.533 1.207 0 O-C-N 120.817 -1.177 . . . . 0.0 110.161 -178.189 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 40.7 mt -96.53 114.41 26.07 Favored 'General case' 0 N--CA 1.449 -0.49 0 N-CA-C 104.713 -2.329 . . . . 0.0 104.713 179.543 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 4.3 t -51.66 153.78 2.23 Favored 'General case' 0 CA--C 1.539 0.531 0 N-CA-C 109.475 -0.565 . . . . 0.0 109.475 179.336 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 55.8 t -44.88 -42.79 2.48 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.124 0 C-N-CA 124.964 1.306 . . . . 0.0 112.205 -178.805 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 1.6 p -63.22 -45.54 91.17 Favored 'General case' 0 CA--C 1.536 0.416 0 CA-C-N 119.034 0.834 . . . . 0.0 112.032 179.859 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -65.97 -45.37 81.93 Favored 'General case' 0 C--O 1.222 -0.38 0 C-N-CA 123.7 0.8 . . . . 0.0 109.083 178.777 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 65.1 t80 -56.07 -52.04 65.69 Favored 'General case' 0 N--CA 1.452 -0.361 0 C-N-CA 124.702 1.201 . . . . 0.0 109.11 179.888 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 3.9 mm -54.79 -62.66 0.7 Allowed 'Isoleucine or valine' 0 N--CA 1.457 -0.087 0 C-N-CA 124.91 1.284 . . . . 0.0 110.588 179.782 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 14.5 ptt180 -58.36 -46.66 85.87 Favored 'General case' 0 C--O 1.222 -0.369 0 CA-C-O 118.311 -0.852 . . . . 0.0 111.368 -178.195 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 22.0 t30 -56.66 -54.57 44.52 Favored 'General case' 0 C--O 1.225 -0.205 0 CA-C-N 119.181 0.901 . . . . 0.0 110.251 -179.748 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -60.25 -33.78 72.78 Favored 'General case' 0 N--CA 1.452 -0.337 0 N-CA-C 112.409 0.522 . . . . 0.0 112.409 -179.45 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -72.24 -40.89 67.39 Favored 'General case' 0 C--O 1.232 0.182 0 N-CA-C 113.049 0.759 . . . . 0.0 113.049 -179.154 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 14.7 mt -85.04 -37.03 20.83 Favored 'General case' 0 C--N 1.331 -0.232 0 C-N-CA 124.334 1.054 . . . . 0.0 113.295 -177.938 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 72.6 m-80 . . . . . 0 C--O 1.259 1.595 0 N-CA-C 113.684 0.994 . . . . 0.0 113.684 -177.095 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 10.5 t . . . . . 0 N--CA 1.449 -0.486 0 N-CA-C 108.302 -0.999 . . . . 0.0 108.302 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 5.6 t -125.43 145.62 32.49 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.588 0 N-CA-C 106.518 -1.66 . . . . 0.0 106.518 179.575 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 9.4 p -137.82 119.1 17.43 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.365 0 N-CA-C 108.46 -0.941 . . . . 0.0 108.46 -179.932 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 17.8 ttt180 -149.43 157.9 43.7 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-O 120.519 0.2 . . . . 0.0 110.814 179.073 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 1.6 m -94.96 93.84 7.65 Favored 'General case' 0 N--CA 1.451 -0.413 0 C-N-CA 125.28 1.432 . . . . 0.0 107.917 179.934 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -95.49 94.8 8.0 Favored 'General case' 0 C--N 1.327 -0.409 0 C-N-CA 124.574 1.15 . . . . 0.0 108.869 -179.654 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 20.5 mmm-85 -76.47 147.68 37.71 Favored 'General case' 0 C--O 1.239 0.514 0 N-CA-C 108.799 -0.815 . . . . 0.0 108.799 179.273 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 22' ' ' PHE . . . . . . . . . . . . . 92.3 m-85 -136.0 153.46 51.37 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 124.674 1.19 . . . . 0.0 108.796 179.541 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 18.7 m -82.04 168.7 22.09 Favored Pre-proline 0 CA--C 1.541 0.614 0 C-N-CA 124.313 1.045 . . . . 0.0 109.74 179.232 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 24' ' ' PRO . . . . . . . . . . . . . 33.0 Cg_endo -64.36 -36.58 44.27 Favored 'Trans proline' 0 C--N 1.349 0.582 0 C-N-CA 121.658 1.572 . . . . 0.0 111.205 -179.391 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 25' ' ' VAL . . . . . . . . . . . . . 86.0 t -66.34 -45.54 89.27 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.211 0 N-CA-C 108.35 -0.981 . . . . 0.0 108.35 179.02 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 96.7 mt-10 -60.9 -49.58 76.88 Favored 'General case' 0 N--CA 1.455 -0.21 0 C-N-CA 123.62 0.768 . . . . 0.0 110.856 -179.319 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 27' ' ' ASP . . . . . . . . . . . . . 33.6 t70 -60.31 -53.27 59.65 Favored 'General case' 0 CA--C 1.502 -0.871 0 CA-C-O 117.401 -1.285 . . . . 0.0 111.751 -179.365 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 28' ' ' GLU . . . . . . . . . . . . . 24.2 mm-40 -57.53 -44.37 85.06 Favored 'General case' 0 N--CA 1.454 -0.258 0 CA-C-N 118.855 0.752 . . . . 0.0 109.012 -179.442 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 30.6 m -58.15 -53.05 62.65 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-N 118.536 0.607 . . . . 0.0 110.45 179.966 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 57.7 mt -61.74 -44.48 98.83 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.269 0 C-N-CA 124.323 1.049 . . . . 0.0 110.831 -179.414 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 24.7 ttt180 -62.62 -46.34 88.7 Favored 'General case' 0 C--N 1.325 -0.486 0 C-N-CA 126.204 1.801 . . . . 0.0 111.32 -178.902 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 4.7 mptp? -66.78 -42.84 85.41 Favored 'General case' 0 CA--C 1.518 -0.253 0 N-CA-C 108.9 -0.778 . . . . 0.0 108.9 -179.561 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 39.3 mmtt -63.15 -53.34 54.91 Favored 'General case' 0 C--O 1.222 -0.389 0 C-N-CA 123.496 0.718 . . . . 0.0 109.93 179.219 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 34' ' ' ALA . . . . . . . . . . . . . . . -52.51 -50.6 62.47 Favored 'General case' 0 C--O 1.236 0.359 0 C-N-CA 124.836 1.254 . . . . 0.0 111.394 -178.826 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -63.76 -39.95 95.51 Favored 'General case' 0 CA--C 1.532 0.258 0 CA-C-O 119.195 -0.431 . . . . 0.0 111.822 -179.573 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 36' ' ' ASP . . . . . . . . . . . . . 37.6 t70 -75.08 -30.73 61.02 Favored 'General case' 0 N--CA 1.465 0.317 0 C-N-CA 123.959 0.904 . . . . 0.0 112.931 -178.285 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 37' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -86.99 -6.13 58.86 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-O 118.156 -0.926 . . . . 0.0 112.459 -179.488 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 75.89 14.35 82.26 Favored Glycine 0 CA--C 1.534 1.262 0 CA-C-N 119.87 1.214 . . . . 0.0 114.172 179.348 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 39' ' ' LEU . . . . . . . . . . . . . 20.9 mt -121.68 112.27 18.22 Favored 'General case' 0 CA--C 1.517 -0.316 0 N-CA-C 105.828 -1.916 . . . . 0.0 105.828 179.623 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 40' ' ' THR . . . . . . . . . . . . . 14.1 t -52.05 156.11 1.67 Allowed 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 124.702 1.201 . . . . 0.0 109.561 179.163 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 41' ' ' VAL . . . . . . . . . . . . . 78.2 t -44.62 -47.39 2.61 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.232 0 C-N-CA 125.216 1.406 . . . . 0.0 112.566 -177.951 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 42' ' ' SER . . . . . . . . . . . . . 14.1 m -63.15 -47.45 82.63 Favored 'General case' 0 CA--C 1.543 0.696 0 CA-C-N 118.792 0.724 . . . . 0.0 111.523 -179.432 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -65.04 -43.3 92.84 Favored 'General case' 0 C--O 1.22 -0.476 0 C-N-CA 124.475 1.11 . . . . 0.0 109.788 178.644 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 44' ' ' TYR . . . . . . . . . . . . . 80.8 t80 -53.79 -53.72 48.35 Favored 'General case' 0 N--CA 1.455 -0.183 0 C-N-CA 125.515 1.526 . . . . 0.0 108.551 179.447 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 45' ' ' ILE . . . . . . . . . . . . . 18.5 mm -54.7 -61.21 1.07 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.226 0 C-N-CA 123.948 0.899 . . . . 0.0 111.202 179.595 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 46' ' ' ARG . . . . . . . . . . . . . 29.0 ptt180 -57.7 -45.23 85.98 Favored 'General case' 0 N--CA 1.466 0.374 0 O-C-N 121.975 -0.453 . . . . 0.0 111.345 -178.324 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 47' ' ' ASN . . . . . . . . . . . . . 35.2 t30 -57.91 -55.63 32.39 Favored 'General case' 0 N--CA 1.449 -0.504 0 C-N-CA 123.697 0.799 . . . . 0.0 111.436 -179.389 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -62.29 -32.01 72.68 Favored 'General case' 0 CA--C 1.529 0.171 0 C-N-CA 124.313 1.045 . . . . 0.0 112.385 -179.656 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 49' ' ' ALA . . . . . . . . . . . . . . . -77.14 -40.91 43.88 Favored 'General case' 0 N--CA 1.451 -0.394 0 N-CA-C 113.195 0.813 . . . . 0.0 113.195 -178.75 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 22.8 mt -74.18 -43.18 58.28 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 118.467 0.576 . . . . 0.0 111.685 -178.919 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 51' ' ' ASN . . . . . . . . . . . . . 53.3 m-80 . . . . . 0 C--O 1.254 1.326 0 CA-C-O 117.951 -1.023 . . . . 0.0 110.927 -179.785 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 4.8 t . . . . . 0 N--CA 1.447 -0.62 0 N-CA-C 109.333 -0.618 . . . . 0.0 109.333 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 9.3 t -109.96 84.5 0.73 Allowed 'Isoleucine or valine' 0 CA--C 1.513 -0.448 0 N-CA-C 109.765 -0.457 . . . . 0.0 109.765 -179.663 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 11.8 p -83.24 121.01 35.55 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.498 0 N-CA-C 105.502 -2.036 . . . . 0.0 105.502 178.107 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 13.0 ttt85 -157.07 163.21 39.26 Favored 'General case' 0 C--O 1.236 0.39 0 N-CA-C 107.79 -1.189 . . . . 0.0 107.79 179.042 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 2.2 m -102.14 130.71 48.84 Favored 'General case' 0 C--N 1.327 -0.413 0 N-CA-C 106.716 -1.587 . . . . 0.0 106.716 179.698 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -130.43 125.87 35.55 Favored 'General case' 0 N--CA 1.448 -0.533 0 N-CA-C 107.005 -1.48 . . . . 0.0 107.005 179.171 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 15.2 mtp180 -107.21 155.55 19.79 Favored 'General case' 0 N--CA 1.455 -0.219 0 C-N-CA 124.306 1.042 . . . . 0.0 111.136 179.666 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 35.5 m-85 -133.73 -171.41 2.71 Favored 'General case' 0 C--O 1.236 0.365 0 C-N-CA 125.567 1.547 . . . . 0.0 108.512 179.787 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 1.2 m -118.18 175.75 1.95 Allowed Pre-proline 0 CA--C 1.539 0.542 0 CA-C-O 117.218 -1.373 . . . . 0.0 107.668 179.433 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_endo -65.0 -51.06 1.77 Allowed 'Trans proline' 0 N--CA 1.458 -0.574 0 CA-C-N 121.458 1.556 . . . . 0.0 111.869 -178.368 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 57.9 t -59.46 -44.3 92.48 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.268 0 C-N-CA 124.713 1.205 . . . . 0.0 111.002 -179.823 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 3.9 mm-40 -65.8 -48.19 72.57 Favored 'General case' 0 C--N 1.331 -0.201 0 C-N-CA 123.852 0.861 . . . . 0.0 110.351 -178.572 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 7.6 t70 -61.42 -43.5 98.77 Favored 'General case' 0 CA--C 1.514 -0.431 0 C-N-CA 124.176 0.99 . . . . 0.0 110.865 179.641 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 45.6 tt0 -61.85 -48.76 79.1 Favored 'General case' 0 N--CA 1.448 -0.554 0 C-N-CA 125.035 1.334 . . . . 0.0 108.568 179.697 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 79.8 m -56.79 -51.72 67.83 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 123.378 0.671 . . . . 0.0 109.222 179.185 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 82.3 mt -62.86 -41.66 93.46 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.41 0 C-N-CA 123.592 0.757 . . . . 0.0 110.296 -179.372 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 14.9 ttt180 -62.44 -52.22 64.39 Favored 'General case' 0 CA--C 1.517 -0.291 0 O-C-N 121.042 -1.036 . . . . 0.0 110.083 -179.928 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 5.0 mptp? -57.69 -47.85 81.2 Favored 'General case' 0 N--CA 1.452 -0.33 0 CA-C-O 118.626 -0.702 . . . . 0.0 109.348 -179.113 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 50.4 mttp -68.46 -35.12 77.11 Favored 'General case' 0 C--O 1.223 -0.29 0 CA-C-O 117.871 -1.061 . . . . 0.0 111.952 -179.173 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -60.81 -52.44 65.08 Favored 'General case' 0 C--N 1.332 -0.162 0 N-CA-C 106.845 -1.539 . . . . 0.0 106.845 177.844 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 8.5 tt0 -62.39 -38.96 91.64 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-N 115.856 -0.611 . . . . 0.0 111.728 -179.389 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 49.6 t0 -66.02 -42.68 89.31 Favored 'General case' 0 N--CA 1.466 0.355 0 N-CA-C 107.959 -1.126 . . . . 0.0 107.959 179.022 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 20.8 t -61.6 -33.27 73.62 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 125.488 1.515 . . . . 0.0 108.102 178.885 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 91.27 38.23 6.02 Favored Glycine 0 N--CA 1.447 -0.583 0 N-CA-C 107.776 -2.13 . . . . 0.0 107.776 -179.032 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 69.1 mt -138.56 159.31 42.42 Favored 'General case' 0 N--CA 1.447 -0.592 0 C-N-CA 126.596 1.958 . . . . 0.0 108.92 -179.17 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 1.7 t -82.37 154.81 25.05 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 104.698 -2.334 . . . . 0.0 104.698 176.906 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 37.4 t -44.93 -42.78 2.51 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.428 0 C-N-CA 126.466 1.907 . . . . 0.0 110.598 178.796 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 6.7 p -58.74 -51.86 68.17 Favored 'General case' 0 CA--C 1.531 0.244 0 CA-C-N 119.66 1.118 . . . . 0.0 111.644 179.52 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -61.15 -47.78 84.64 Favored 'General case' 0 N--CA 1.455 -0.196 0 C-N-CA 124.728 1.211 . . . . 0.0 109.731 179.195 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 77.3 t80 -55.32 -47.17 76.05 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 124.369 1.068 . . . . 0.0 109.5 179.581 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 3.0 mm -57.42 -66.53 0.32 Allowed 'Isoleucine or valine' 0 C--O 1.225 -0.225 0 C-N-CA 125.267 1.427 . . . . 0.0 110.03 179.327 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 9.2 ptm180 -54.37 -40.98 68.64 Favored 'General case' 0 C--O 1.22 -0.472 0 CA-C-O 118.001 -1.0 . . . . 0.0 112.914 -178.501 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 34.9 t30 -68.97 -45.12 71.47 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 119.642 1.11 . . . . 0.0 112.4 -179.339 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -64.76 -33.4 75.9 Favored 'General case' 0 C--O 1.224 -0.288 0 CA-C-N 118.468 0.576 . . . . 0.0 109.943 178.869 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -72.84 -14.25 61.46 Favored 'General case' 0 N--CA 1.453 -0.305 0 C-N-CA 124.199 0.999 . . . . 0.0 112.99 -179.375 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 20.7 mt -100.47 -40.88 7.23 Favored 'General case' 0 CA--C 1.509 -0.626 0 CA-C-O 118.277 -0.868 . . . . 0.0 109.9 178.826 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 70.0 m-80 . . . . . 0 C--O 1.251 1.178 0 O-C-N 124.455 1.097 . . . . 0.0 110.687 179.519 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 10.9 t . . . . . 0 N--CA 1.45 -0.458 0 N-CA-C 108.435 -0.95 . . . . 0.0 108.435 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 2.8 t -136.12 88.9 0.75 Allowed 'Isoleucine or valine' 0 N--CA 1.447 -0.594 0 N-CA-C 106.948 -1.501 . . . . 0.0 106.948 -179.593 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 8.3 p -85.5 103.7 12.68 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.447 0 N-CA-C 104.751 -2.314 . . . . 0.0 104.751 178.689 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 36.1 ttt85 -137.66 165.57 26.06 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 108.376 -0.972 . . . . 0.0 108.376 -179.669 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 35.1 m -112.67 120.66 42.31 Favored 'General case' 0 N--CA 1.449 -0.483 0 N-CA-C 105.275 -2.12 . . . . 0.0 105.275 179.696 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -118.75 111.71 18.82 Favored 'General case' 0 CA--C 1.517 -0.317 0 C-N-CA 123.699 0.799 . . . . 0.0 109.686 -178.242 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 62.0 mtm180 -90.08 153.91 20.19 Favored 'General case' 0 N--CA 1.454 -0.259 0 CA-C-O 121.225 0.536 . . . . 0.0 111.283 179.362 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 22' ' ' PHE . . . . . . . . . . . . . 63.9 m-85 -139.33 162.36 35.19 Favored 'General case' 0 C--O 1.235 0.298 0 C-N-CA 126.833 2.053 . . . . 0.0 107.256 -179.588 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -94.86 177.82 1.7 Allowed Pre-proline 0 CA--C 1.546 0.824 0 N-CA-C 108.463 -0.939 . . . . 0.0 108.463 179.069 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 24' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -71.32 -23.47 24.03 Favored 'Trans proline' 0 N--CA 1.461 -0.402 0 C-N-CA 121.583 1.522 . . . . 0.0 114.458 -177.843 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 25' ' ' VAL . . . . . . . . . . . . . 98.6 t -75.35 -45.7 39.93 Favored 'Isoleucine or valine' 0 C--O 1.235 0.327 0 N-CA-C 107.608 -1.256 . . . . 0.0 107.608 179.823 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -63.67 -40.81 97.77 Favored 'General case' 0 N--CA 1.451 -0.419 0 CA-C-O 119.207 -0.425 . . . . 0.0 110.398 179.22 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 27' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -62.43 -48.08 81.23 Favored 'General case' 0 CA--C 1.51 -0.564 0 C-N-CA 123.289 0.635 . . . . 0.0 111.494 -179.702 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 28' ' ' GLU . . . . . . . . . . . . . 29.3 tt0 -60.34 -49.28 78.22 Favored 'General case' 0 N--CA 1.449 -0.524 0 N-CA-C 108.679 -0.859 . . . . 0.0 108.679 179.15 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 49.6 m -58.23 -57.21 13.89 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 122.701 0.4 . . . . 0.0 110.131 -179.818 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 55.4 mt -56.5 -47.23 82.12 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.272 0 C-N-CA 124.08 0.952 . . . . 0.0 110.888 -179.253 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 23.3 ttt-85 -62.23 -44.57 96.27 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 118.378 -0.82 . . . . 0.0 111.367 -178.922 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 1.7 mptm? -61.9 -50.89 70.37 Favored 'General case' 0 C--O 1.226 -0.167 0 CA-C-N 118.618 0.644 . . . . 0.0 109.406 179.4 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 4.6 mptp? -62.53 -42.69 99.69 Favored 'General case' 0 N--CA 1.466 0.354 0 C-N-CA 123.193 0.597 . . . . 0.0 111.57 -179.023 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 34' ' ' ALA . . . . . . . . . . . . . . . -58.6 -53.06 62.59 Favored 'General case' 0 N--CA 1.451 -0.405 0 C-N-CA 123.645 0.778 . . . . 0.0 109.521 179.436 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 14.1 tt0 -62.35 -39.97 94.86 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-O 118.689 -0.672 . . . . 0.0 111.335 -178.037 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 36' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -60.59 -46.57 89.75 Favored 'General case' 0 CA--C 1.516 -0.34 0 C-N-CA 126.385 1.874 . . . . 0.0 108.33 179.099 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 37' ' ' SER . . . . . . . . . . . . . 6.3 t -73.22 -14.35 61.32 Favored 'General case' 0 N--CA 1.451 -0.399 0 C-N-CA 120.935 -0.306 . . . . 0.0 110.934 -179.686 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 81.92 2.97 90.71 Favored Glycine 0 CA--C 1.528 0.9 0 CA-C-O 118.713 -1.048 . . . . 0.0 111.71 -179.479 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 39' ' ' LEU . . . . . . . . . . . . . 64.0 mt -100.2 123.36 44.33 Favored 'General case' 0 N--CA 1.445 -0.698 0 C-N-CA 127.627 2.371 . . . . 0.0 106.269 -179.4 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 40' ' ' THR . . . . . . . . . . . . . 11.7 t -54.38 153.63 5.3 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 108.791 -0.818 . . . . 0.0 108.791 178.753 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 41' ' ' VAL . . . . . . . . . . . . . 56.1 t -47.6 -43.35 9.25 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.326 0 C-N-CA 124.768 1.227 . . . . 0.0 111.874 -179.21 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 42' ' ' SER . . . . . . . . . . . . . 2.1 p -61.26 -44.95 96.41 Favored 'General case' 0 CA--C 1.535 0.366 0 O-C-N 121.499 -0.751 . . . . 0.0 111.392 179.397 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -65.63 -44.29 86.89 Favored 'General case' 0 C--O 1.224 -0.271 0 C-N-CA 123.587 0.755 . . . . 0.0 108.98 178.692 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 44' ' ' TYR . . . . . . . . . . . . . 64.2 t80 -53.79 -50.5 65.95 Favored 'General case' 0 N--CA 1.454 -0.262 0 C-N-CA 124.654 1.182 . . . . 0.0 109.955 179.684 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 45' ' ' ILE . . . . . . . . . . . . . 10.0 mm -55.41 -62.48 0.79 Allowed 'Isoleucine or valine' 0 N--CA 1.463 0.196 0 C-N-CA 123.984 0.914 . . . . 0.0 111.41 179.853 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 46' ' ' ARG . . . . . . . . . . . . . 7.3 ptm180 -56.89 -40.64 76.61 Favored 'General case' 0 C--O 1.223 -0.342 0 CA-C-O 119.041 -0.504 . . . . 0.0 111.03 -179.045 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 47' ' ' ASN . . . . . . . . . . . . . 24.3 t30 -60.75 -55.38 33.89 Favored 'General case' 0 N--CA 1.449 -0.51 0 C-N-CA 123.677 0.791 . . . . 0.0 110.417 -179.583 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -61.46 -31.23 71.18 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 123.783 0.833 . . . . 0.0 112.382 -179.659 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 49' ' ' ALA . . . . . . . . . . . . . . . -75.27 -21.17 58.73 Favored 'General case' 0 N--CA 1.447 -0.595 0 N-CA-C 113.807 1.04 . . . . 0.0 113.807 -179.322 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 20.8 mt -101.12 -36.09 9.09 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-N 118.577 0.626 . . . . 0.0 110.468 -179.883 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 51' ' ' ASN . . . . . . . . . . . . . 58.0 m-80 . . . . . 0 C--O 1.246 0.898 0 CA-C-O 117.319 -1.324 . . . . 0.0 110.103 179.88 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 3.4 t . . . . . 0 N--CA 1.44 -0.925 0 CA-C-O 123.342 1.544 . . . . 0.0 109.153 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 3.1 t -142.08 143.37 26.67 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.881 0 N-CA-C 102.993 -2.966 . . . . 0.0 102.993 178.328 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 8.6 p -139.04 119.73 15.25 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.064 0 N-CA-C 106.409 -1.7 . . . . 0.0 106.409 178.77 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 52.6 ttm-85 -139.08 158.31 44.41 Favored 'General case' 0 CA--C 1.51 -0.568 0 CA-C-N 114.773 -1.103 . . . . 0.0 109.3 179.487 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 19.6 m -104.74 97.43 7.32 Favored 'General case' 0 N--CA 1.445 -0.68 0 N-CA-C 100.379 -3.934 . . . . 0.0 100.379 178.05 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 53.3 tp -109.9 92.29 3.99 Favored 'General case' 0 N--CA 1.448 -0.532 0 C-N-CA 125.964 1.706 . . . . 0.0 111.537 -178.038 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 8.3 mpt_? -66.78 156.08 36.47 Favored 'General case' 0 N--CA 1.44 -0.966 0 C-N-CA 123.94 0.896 . . . . 0.0 110.151 177.054 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 62.7 m-85 -131.48 147.53 52.56 Favored 'General case' 0 N--CA 1.466 0.355 0 N-CA-C 104.125 -2.546 . . . . 0.0 104.125 177.25 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 1.1 m -76.83 169.52 20.74 Favored Pre-proline 0 CA--C 1.545 0.757 0 N-CA-C 109.07 -0.715 . . . . 0.0 109.07 -179.004 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 59.5 Cg_endo -67.17 -32.25 34.27 Favored 'Trans proline' 0 C--N 1.345 0.377 0 C-N-CA 121.946 1.764 . . . . 0.0 113.584 -178.562 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 55.9 t -74.29 -49.31 32.83 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.174 0 N-CA-C 107.471 -1.307 . . . . 0.0 107.471 179.228 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 2.4 mp0 -56.24 -46.07 79.74 Favored 'General case' 0 N--CA 1.449 -0.514 0 C-N-CA 124.825 1.25 . . . . 0.0 108.976 179.578 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -62.26 -48.05 81.64 Favored 'General case' 0 CA--C 1.512 -0.51 0 C-N-CA 123.874 0.87 . . . . 0.0 111.999 179.58 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 39.7 tt0 -59.2 -48.4 81.75 Favored 'General case' 0 N--CA 1.452 -0.35 0 N-CA-C 108.896 -0.779 . . . . 0.0 108.896 -179.888 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 51.9 m -59.04 -55.18 38.45 Favored 'General case' 0 N--CA 1.455 -0.206 0 C-N-CA 123.585 0.754 . . . . 0.0 109.213 179.377 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 90.3 mt -58.5 -41.53 82.02 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.245 0 C-N-CA 123.327 0.651 . . . . 0.0 110.366 -179.176 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 54.5 ttt180 -60.62 -49.9 75.69 Favored 'General case' 0 N--CA 1.462 0.15 0 CA-C-N 119.301 0.955 . . . . 0.0 108.981 179.038 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 5.2 mptp? -58.16 -53.02 62.99 Favored 'General case' 0 C--O 1.225 -0.206 0 N-CA-C 109.077 -0.712 . . . . 0.0 109.077 179.578 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -59.99 -43.19 95.31 Favored 'General case' 0 CA--C 1.517 -0.304 0 C-N-CA 123.342 0.657 . . . . 0.0 112.173 -178.64 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -63.76 -48.63 76.17 Favored 'General case' 0 N--CA 1.446 -0.635 0 C-N-CA 124.441 1.096 . . . . 0.0 110.244 -179.787 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 27.7 tt0 -67.06 -32.92 74.43 Favored 'General case' 0 CA--C 1.533 0.297 0 O-C-N 121.364 -0.835 . . . . 0.0 110.877 179.891 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 8.1 t70 -70.17 -44.79 68.03 Favored 'General case' 0 CA--C 1.514 -0.437 0 C-N-CA 124.334 1.054 . . . . 0.0 108.857 -178.986 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 22.7 t -75.63 -9.8 58.9 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 124.78 1.232 . . . . 0.0 110.324 178.678 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 74.14 -6.89 18.91 Favored Glycine 0 CA--C 1.532 1.153 0 CA-C-O 118.845 -0.975 . . . . 0.0 111.014 -178.632 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 44.1 mt -88.41 119.17 28.59 Favored 'General case' 0 CA--C 1.513 -0.479 0 CA-C-N 119.89 1.845 . . . . 0.0 107.316 -179.429 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 5.2 t -48.37 151.36 1.08 Allowed 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 124.396 1.078 . . . . 0.0 109.768 178.884 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 41.6 t -46.72 -45.26 7.27 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.315 0 C-N-CA 125.018 1.327 . . . . 0.0 111.447 -178.762 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 54.3 m -61.2 -47.45 86.07 Favored 'General case' 0 CA--C 1.539 0.55 0 O-C-N 121.453 -0.78 . . . . 0.0 111.644 179.705 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -64.96 -44.16 90.29 Favored 'General case' 0 C--O 1.223 -0.317 0 C-N-CA 123.828 0.851 . . . . 0.0 109.36 178.787 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 80.8 t80 -55.12 -51.27 66.96 Favored 'General case' 0 N--CA 1.45 -0.471 0 C-N-CA 124.899 1.28 . . . . 0.0 109.837 179.725 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 12.1 mm -55.56 -65.86 0.33 Allowed 'Isoleucine or valine' 0 C--N 1.339 0.132 0 C-N-CA 124.897 1.279 . . . . 0.0 110.416 179.734 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 11.5 ptt180 -55.6 -44.94 77.45 Favored 'General case' 0 C--O 1.22 -0.452 0 CA-C-O 117.894 -1.05 . . . . 0.0 111.843 -178.241 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 30.8 t30 -58.35 -52.1 67.03 Favored 'General case' 0 CA--C 1.529 0.148 0 CA-C-N 119.322 0.964 . . . . 0.0 110.133 179.653 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -61.29 -30.84 70.73 Favored 'General case' 0 CA--C 1.533 0.316 0 N-CA-C 112.246 0.462 . . . . 0.0 112.246 179.749 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -82.37 -32.2 29.37 Favored 'General case' 0 C--O 1.222 -0.355 0 N-CA-C 114.817 1.414 . . . . 0.0 114.817 -178.969 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 22.1 mt -81.8 -41.58 20.92 Favored 'General case' 0 CA--C 1.508 -0.667 0 N-CA-C 113.944 1.09 . . . . 0.0 113.944 -177.551 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 69.5 m-80 . . . . . 0 C--O 1.251 1.141 0 CA-C-O 117.661 -1.162 . . . . 0.0 109.054 -178.896 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 1.3 t . . . . . 0 N--CA 1.444 -0.726 0 CA-C-O 122.032 0.92 . . . . 0.0 108.83 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 19.4 t -114.39 142.75 25.97 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.573 0 N-CA-C 105.771 -1.937 . . . . 0.0 105.771 179.325 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 12.4 p -135.8 108.93 9.17 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 N-CA-C 106.188 -1.782 . . . . 0.0 106.188 178.675 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 43.4 ttm-85 -134.38 150.04 50.87 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-N 115.855 -0.612 . . . . 0.0 110.1 -179.745 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 22.5 m -88.57 75.45 8.32 Favored 'General case' 0 N--CA 1.45 -0.459 0 C-N-CA 125.264 1.426 . . . . 0.0 108.265 179.801 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 16.6 tp -86.44 136.99 32.9 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 105.947 -1.872 . . . . 0.0 105.947 178.818 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 78.9 mtt180 -132.62 166.75 21.42 Favored 'General case' 0 N--CA 1.451 -0.42 0 C-N-CA 127.182 2.193 . . . . 0.0 110.094 -179.078 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 22' ' ' PHE . . . . . . . . . . . . . 87.6 m-85 -136.76 -178.04 5.01 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 124.611 1.164 . . . . 0.0 110.114 -179.721 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -105.83 173.48 3.2 Favored Pre-proline 0 CA--C 1.542 0.663 0 C-N-CA 124.181 0.992 . . . . 0.0 109.751 179.758 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 24' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -68.32 -37.83 12.99 Favored 'Trans proline' 0 C--N 1.347 0.471 0 C-N-CA 121.55 1.5 . . . . 0.0 114.371 -177.494 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 25' ' ' VAL . . . . . . . . . . . . . 81.6 t -74.97 -41.6 45.93 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.202 0 N-CA-C 108.793 -0.818 . . . . 0.0 108.793 179.489 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -60.39 -51.71 68.32 Favored 'General case' 0 N--CA 1.45 -0.469 0 C-N-CA 126.559 1.944 . . . . 0.0 109.941 -178.776 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 27' ' ' ASP . . . . . . . . . . . . . 16.8 t70 -61.11 -49.85 75.64 Favored 'General case' 0 CA--C 1.512 -0.515 0 C-N-CA 124.732 1.213 . . . . 0.0 110.676 179.601 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 28' ' ' GLU . . . . . . . . . . . . . 31.1 tt0 -58.85 -45.23 90.58 Favored 'General case' 0 N--CA 1.447 -0.601 0 N-CA-C 109.106 -0.701 . . . . 0.0 109.106 -179.757 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 99.1 m -59.97 -55.93 27.93 Favored 'General case' 0 CA--C 1.53 0.199 0 CA-C-N 118.677 0.671 . . . . 0.0 109.288 179.062 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 65.6 mt -55.6 -42.93 71.0 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.215 0 C-N-CA 123.012 0.525 . . . . 0.0 109.912 -179.76 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 77.3 ttt180 -64.41 -44.6 90.73 Favored 'General case' 0 N--CA 1.45 -0.442 0 CA-C-O 118.336 -0.84 . . . . 0.0 111.246 -179.185 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 1.6 mptp? -62.69 -47.19 84.73 Favored 'General case' 0 C--O 1.222 -0.363 0 CA-C-O 118.101 -0.952 . . . . 0.0 109.062 179.579 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 1.5 mptm? -61.83 -47.82 83.37 Favored 'General case' 0 CA--C 1.518 -0.272 0 CA-C-N 119.48 1.036 . . . . 0.0 110.369 -179.736 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 34' ' ' ALA . . . . . . . . . . . . . . . -54.63 -57.86 9.79 Favored 'General case' 0 N--CA 1.448 -0.554 0 C-N-CA 124.94 1.296 . . . . 0.0 109.866 179.456 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 41.3 tt0 -61.81 -41.59 97.95 Favored 'General case' 0 N--CA 1.464 0.273 0 C-N-CA 124.649 1.18 . . . . 0.0 112.271 -178.946 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 36' ' ' ASP . . . . . . . . . . . . . 4.8 t70 -61.02 -42.32 98.24 Favored 'General case' 0 C--N 1.332 -0.184 0 C-N-CA 124.613 1.165 . . . . 0.0 108.393 179.617 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 37' ' ' SER . . . . . . . . . . . . . 29.5 t -77.68 -7.82 57.01 Favored 'General case' 0 N--CA 1.445 -0.684 0 C-N-CA 124.598 1.159 . . . . 0.0 110.839 179.107 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 77.13 15.05 81.97 Favored Glycine 0 CA--C 1.523 0.563 0 CA-C-O 117.061 -1.966 . . . . 0.0 115.998 178.895 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 39' ' ' LEU . . . . . . . . . . . . . 8.3 mt -120.68 143.37 48.76 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-N 120.892 2.346 . . . . 0.0 106.214 179.542 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 40' ' ' THR . . . . . . . . . . . . . 10.1 t -63.85 152.16 40.42 Favored 'General case' 0 C--N 1.321 -0.671 0 O-C-N 120.964 -1.085 . . . . 0.0 108.393 178.939 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 41' ' ' VAL . . . . . . . . . . . . . 52.6 t -48.07 -42.02 10.27 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.254 0 C-N-CA 125.267 1.427 . . . . 0.0 111.452 179.319 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 42' ' ' SER . . . . . . . . . . . . . 70.7 m -57.94 -43.09 86.14 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-N 120.301 1.409 . . . . 0.0 111.716 179.923 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -65.11 -51.04 63.63 Favored 'General case' 0 N--CA 1.452 -0.345 0 N-CA-C 107.529 -1.286 . . . . 0.0 107.529 178.087 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 44' ' ' TYR . . . . . . . . . . . . . 69.5 t80 -53.98 -45.71 71.49 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 123.548 0.739 . . . . 0.0 111.362 -179.647 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 45' ' ' ILE . . . . . . . . . . . . . 16.0 mm -59.47 -68.43 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.34 0.184 0 C-N-CA 125.352 1.461 . . . . 0.0 109.904 179.718 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 46' ' ' ARG . . . . . . . . . . . . . 17.8 ptt85 -51.65 -44.92 63.18 Favored 'General case' 0 C--O 1.219 -0.538 0 CA-C-O 118.971 -0.538 . . . . 0.0 110.537 -178.373 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 47' ' ' ASN . . . . . . . . . . . . . 32.4 t30 -62.43 -47.78 82.56 Favored 'General case' 0 N--CA 1.444 -0.758 0 CA-C-O 117.639 -1.172 . . . . 0.0 112.47 -179.008 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -64.41 -29.14 70.2 Favored 'General case' 0 CA--C 1.531 0.237 0 CA-C-N 119.115 0.87 . . . . 0.0 110.514 179.544 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 49' ' ' ALA . . . . . . . . . . . . . . . -73.75 -21.28 60.25 Favored 'General case' 0 CA--C 1.539 0.522 0 N-CA-C 112.494 0.554 . . . . 0.0 112.494 179.575 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 6.3 mt -101.33 -33.79 9.88 Favored 'General case' 0 N--CA 1.463 0.223 0 C-N-CA 124.532 1.133 . . . . 0.0 109.783 -179.085 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 51' ' ' ASN . . . . . . . . . . . . . 69.4 m-80 . . . . . 0 C--O 1.253 1.263 0 C-N-CA 125.671 1.589 . . . . 0.0 109.11 178.984 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 3.9 t . . . . . 0 N--CA 1.447 -0.587 0 N-CA-C 108.605 -0.887 . . . . 0.0 108.605 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 4.1 t -109.0 138.77 34.58 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.635 0 N-CA-C 103.65 -2.722 . . . . 0.0 103.65 178.164 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 11.5 p -140.73 117.26 7.9 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.388 0 N-CA-C 106.639 -1.615 . . . . 0.0 106.639 178.89 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 33.3 ttt180 -150.19 173.31 14.07 Favored 'General case' 0 C--O 1.236 0.375 0 N-CA-C 107.835 -1.172 . . . . 0.0 107.835 -179.782 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 27.1 m -111.46 120.35 41.87 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 104.895 -2.261 . . . . 0.0 104.895 179.078 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -120.62 104.68 10.12 Favored 'General case' 0 N--CA 1.449 -0.511 0 N-CA-C 106.32 -1.733 . . . . 0.0 106.32 179.484 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 26.3 mtm-85 -84.98 157.16 20.86 Favored 'General case' 0 N--CA 1.448 -0.543 0 N-CA-C 109.662 -0.495 . . . . 0.0 109.662 178.874 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 97.5 m-85 -137.66 163.42 31.3 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 108.321 -0.992 . . . . 0.0 108.321 179.936 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 19.3 m -91.98 168.3 13.32 Favored Pre-proline 0 CA--C 1.547 0.834 0 CA-C-O 118.154 -0.927 . . . . 0.0 108.53 179.734 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 45.8 Cg_endo -63.14 -41.97 25.41 Favored 'Trans proline' 0 C--N 1.348 0.529 0 C-N-CA 121.72 1.613 . . . . 0.0 113.03 -177.499 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 65.6 t -68.2 -26.61 34.52 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.363 0 C-N-CA 123.963 0.905 . . . . 0.0 110.561 -179.654 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 4.2 mm-40 -81.65 -38.12 26.42 Favored 'General case' 0 C--N 1.333 -0.124 0 C-N-CA 124.083 0.953 . . . . 0.0 109.572 -179.297 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -69.04 -44.08 73.38 Favored 'General case' 0 C--O 1.221 -0.416 0 C-N-CA 125.429 1.492 . . . . 0.0 108.636 178.626 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 24.6 tt0 -54.22 -52.32 61.64 Favored 'General case' 0 N--CA 1.451 -0.382 0 C-N-CA 126.615 1.966 . . . . 0.0 109.455 179.064 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 72.8 m -65.79 -52.01 54.31 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-O 118.969 -0.538 . . . . 0.0 110.915 -179.4 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 71.1 mt -58.53 -41.75 82.71 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.261 0 CA-C-N 118.191 0.451 . . . . 0.0 110.611 -178.694 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 50.7 ttt85 -64.94 -48.66 73.32 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-O 118.868 -0.586 . . . . 0.0 110.352 -179.516 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 11.7 mptt -63.87 -46.88 82.97 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-O 118.737 -0.649 . . . . 0.0 111.002 -179.243 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.8 -43.38 98.95 Favored 'General case' 0 C--O 1.228 -0.041 0 CA-C-N 118.63 0.65 . . . . 0.0 110.218 -179.508 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -59.16 -52.74 64.42 Favored 'General case' 0 N--CA 1.454 -0.25 0 C-N-CA 123.842 0.857 . . . . 0.0 110.128 179.455 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 18.0 tt0 -59.39 -39.25 82.74 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 123.392 0.677 . . . . 0.0 111.784 -178.896 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -71.3 -40.91 70.56 Favored 'General case' 0 N--CA 1.463 0.196 0 CA-C-N 118.416 0.553 . . . . 0.0 109.913 178.841 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 23.1 t -69.38 -9.04 51.72 Favored 'General case' 0 N--CA 1.448 -0.542 0 C-N-CA 123.606 0.762 . . . . 0.0 110.66 179.788 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 67.42 20.74 71.88 Favored Glycine 0 CA--C 1.527 0.83 0 CA-C-N 119.061 0.846 . . . . 0.0 111.064 -179.203 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 70.6 mt -117.71 116.79 27.74 Favored 'General case' 0 CA--C 1.513 -0.474 0 N-CA-C 104.148 -2.538 . . . . 0.0 104.148 179.791 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 5.2 t -54.24 152.2 6.48 Favored 'General case' 0 CA--C 1.539 0.533 0 N-CA-C 108.551 -0.907 . . . . 0.0 108.551 179.171 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 53.1 t -45.71 -43.25 4.08 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.224 0 C-N-CA 124.02 0.928 . . . . 0.0 111.629 -179.479 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 8.9 p -59.35 -47.03 86.94 Favored 'General case' 0 CA--C 1.536 0.42 0 O-C-N 121.58 -0.7 . . . . 0.0 111.614 -179.954 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -67.01 -43.25 83.36 Favored 'General case' 0 N--CA 1.454 -0.226 0 C-N-CA 124.454 1.102 . . . . 0.0 109.967 178.992 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 36.2 t80 -53.74 -51.38 63.54 Favored 'General case' 0 N--CA 1.453 -0.319 0 C-N-CA 125.265 1.426 . . . . 0.0 109.137 179.684 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 8.3 mm -53.82 -63.21 0.55 Allowed 'Isoleucine or valine' 0 CA--C 1.529 0.14 0 C-N-CA 124.668 1.187 . . . . 0.0 110.093 179.733 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 6.9 ptm180 -56.83 -44.99 82.6 Favored 'General case' 0 C--O 1.224 -0.28 0 CA-C-O 118.296 -0.859 . . . . 0.0 112.718 -178.744 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 25.5 t30 -59.55 -53.07 62.38 Favored 'General case' 0 C--O 1.232 0.143 0 C-N-CA 124.449 1.1 . . . . 0.0 110.468 -179.912 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -62.67 -33.09 74.36 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 123.316 0.646 . . . . 0.0 111.324 179.834 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -75.26 -15.34 60.53 Favored 'General case' 0 CA--C 1.536 0.421 0 N-CA-C 114.128 1.158 . . . . 0.0 114.128 -179.673 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 17.6 mt -107.05 -34.77 7.07 Favored 'General case' 0 CA--C 1.517 -0.297 0 CA-C-N 119.426 1.012 . . . . 0.0 112.418 -179.889 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 56.2 m-80 . . . . . 0 C--O 1.247 0.968 0 C-N-CA 123.654 0.782 . . . . 0.0 111.595 -178.981 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 4.1 t . . . . . 0 N--CA 1.439 -0.985 0 CA-C-O 122.142 0.972 . . . . 0.0 110.548 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 36.0 t -101.51 152.42 5.27 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 N-CA-C 105.409 -2.071 . . . . 0.0 105.409 178.422 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 11.1 p -147.66 110.82 0.72 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 N-CA-C 103.501 -2.777 . . . . 0.0 103.501 178.121 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 32.2 ttt180 -145.0 158.71 43.73 Favored 'General case' 0 C--O 1.233 0.197 0 O-C-N 121.274 -0.891 . . . . 0.0 113.299 -178.425 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 3.9 m -92.23 80.18 5.03 Favored 'General case' 0 N--CA 1.451 -0.377 0 C-N-CA 125.998 1.719 . . . . 0.0 107.812 -179.361 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -85.62 93.02 8.72 Favored 'General case' 0 C--N 1.326 -0.439 0 O-C-N 121.32 -0.863 . . . . 0.0 109.102 -179.453 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 14.5 mmm-85 -78.44 154.2 30.82 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 122.987 0.515 . . . . 0.0 110.179 179.101 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 22' ' ' PHE . . . . . . . . . . . . . 92.0 m-85 -141.35 174.18 10.78 Favored 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 125.506 1.522 . . . . 0.0 108.269 179.139 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 3.2 m -104.25 176.66 1.67 Allowed Pre-proline 0 CA--C 1.544 0.716 0 CA-C-O 117.809 -1.091 . . . . 0.0 110.124 179.562 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 24' ' ' PRO . . . . . . . . . . . . . 85.7 Cg_endo -77.17 -29.0 5.35 Favored 'Trans proline' 0 C--N 1.35 0.62 0 CA-C-N 121.519 1.578 . . . . 0.0 112.634 -178.107 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 25' ' ' VAL . . . . . . . . . . . . . 11.4 t -75.66 -34.66 29.34 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.177 0 N-CA-C 107.295 -1.372 . . . . 0.0 107.295 179.237 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -69.08 -45.63 69.8 Favored 'General case' 0 N--CA 1.447 -0.595 0 N-CA-C 107.48 -1.304 . . . . 0.0 107.48 178.41 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 27' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -60.7 -49.3 78.05 Favored 'General case' 0 C--O 1.218 -0.601 0 N-CA-C 109.194 -0.669 . . . . 0.0 109.194 179.097 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 28' ' ' GLU . . . . . . . . . . . . . 36.4 tt0 -61.32 -23.03 65.43 Favored 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 123.965 0.906 . . . . 0.0 111.48 -179.806 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 88.6 m -85.21 -53.92 4.94 Favored 'General case' 0 N--CA 1.452 -0.35 0 N-CA-C 108.035 -1.098 . . . . 0.0 108.035 178.616 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 58.8 mt -58.43 -46.16 89.57 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.507 0 C-N-CA 124.591 1.156 . . . . 0.0 110.18 -179.278 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 54.0 ttt85 -59.98 -52.33 65.87 Favored 'General case' 0 N--CA 1.451 -0.387 0 C-N-CA 124.299 1.04 . . . . 0.0 110.142 -179.456 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 5.9 mptt -59.42 -48.44 81.65 Favored 'General case' 0 N--CA 1.456 -0.164 0 O-C-N 123.711 0.632 . . . . 0.0 110.499 -179.073 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -67.02 -38.46 86.0 Favored 'General case' 0 C--O 1.226 -0.158 0 CA-C-N 118.123 0.42 . . . . 0.0 112.085 -178.586 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 34' ' ' ALA . . . . . . . . . . . . . . . -59.94 -52.81 63.82 Favored 'General case' 0 N--CA 1.452 -0.371 0 C-N-CA 124.015 0.926 . . . . 0.0 108.79 179.034 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 5.9 tt0 -65.73 -30.84 71.57 Favored 'General case' 0 CA--C 1.534 0.348 0 O-C-N 122.217 -0.302 . . . . 0.0 110.755 -178.962 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 36' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -67.32 -42.29 83.86 Favored 'General case' 0 N--CA 1.462 0.147 0 C-N-CA 124.264 1.026 . . . . 0.0 108.242 178.697 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 37' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -74.51 -21.57 59.48 Favored 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 124.356 1.063 . . . . 0.0 110.675 178.781 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 85.56 -5.93 81.91 Favored Glycine 0 CA--C 1.537 1.428 0 N-CA-C 109.71 -1.356 . . . . 0.0 109.71 -177.688 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 39' ' ' LEU . . . . . . . . . . . . . 84.4 mt -89.01 110.27 20.99 Favored 'General case' 0 N--CA 1.445 -0.687 0 C-N-CA 128.144 2.578 . . . . 0.0 105.68 179.312 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 40' ' ' THR . . . . . . . . . . . . . 5.0 t -48.04 155.2 0.47 Allowed 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 123.777 0.831 . . . . 0.0 109.589 178.184 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 41' ' ' VAL . . . . . . . . . . . . . 52.9 t -45.65 -43.2 3.95 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.505 0 C-N-CA 124.479 1.112 . . . . 0.0 111.441 -179.392 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 42' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -64.26 -35.64 81.49 Favored 'General case' 0 CA--C 1.542 0.638 0 O-C-N 121.487 -0.758 . . . . 0.0 112.93 179.823 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -76.25 -44.51 37.09 Favored 'General case' 0 C--O 1.226 -0.162 0 C-N-CA 126.277 1.831 . . . . 0.0 108.957 178.579 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 44' ' ' TYR . . . . . . . . . . . . . 64.0 t80 -55.69 -51.93 65.59 Favored 'General case' 0 N--CA 1.446 -0.659 0 C-N-CA 124.812 1.245 . . . . 0.0 109.256 179.5 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 45' ' ' ILE . . . . . . . . . . . . . 21.6 mm -54.96 -60.43 1.6 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.395 0 C-N-CA 123.86 0.864 . . . . 0.0 111.739 179.653 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 46' ' ' ARG . . . . . . . . . . . . . 3.3 ptm180 -53.91 -45.58 71.21 Favored 'General case' 0 C--O 1.224 -0.246 0 CA-C-O 118.429 -0.796 . . . . 0.0 111.368 -179.508 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 47' ' ' ASN . . . . . . . . . . . . . 27.4 t30 -62.24 -57.02 12.96 Favored 'General case' 0 N--CA 1.452 -0.343 0 C-N-CA 124.939 1.296 . . . . 0.0 110.878 -179.473 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -58.13 -30.58 66.44 Favored 'General case' 0 C--N 1.334 -0.093 0 C-N-CA 123.891 0.876 . . . . 0.0 113.264 -178.725 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 49' ' ' ALA . . . . . . . . . . . . . . . -82.58 -29.35 30.31 Favored 'General case' 0 N--CA 1.451 -0.41 0 N-CA-C 114.274 1.213 . . . . 0.0 114.274 -179.208 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 43.7 mt -84.88 -37.6 20.43 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-N 119.084 0.856 . . . . 0.0 111.171 -179.234 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 51' ' ' ASN . . . . . . . . . . . . . 63.5 m-20 . . . . . 0 C--O 1.251 1.149 0 CA-C-O 116.576 -1.678 . . . . 0.0 110.324 179.33 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 4.1 t . . . . . 0 N--CA 1.437 -1.097 0 CA-C-O 122.161 0.981 . . . . 0.0 108.355 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 24.7 t -109.71 147.03 14.39 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.763 0 N-CA-C 104.437 -2.431 . . . . 0.0 104.437 176.665 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 11.3 p -143.44 105.45 1.01 Allowed 'Isoleucine or valine' 0 N--CA 1.445 -0.709 0 N-CA-C 104.431 -2.433 . . . . 0.0 104.431 178.198 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 49.5 ttm-85 -148.34 156.02 42.0 Favored 'General case' 0 C--N 1.325 -0.462 0 C-N-CA 123.245 0.618 . . . . 0.0 109.743 -179.344 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 23.4 m -103.62 129.7 50.94 Favored 'General case' 0 N--CA 1.451 -0.402 0 N-CA-C 104.07 -2.567 . . . . 0.0 104.07 178.445 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -135.98 111.66 9.36 Favored 'General case' 0 N--CA 1.453 -0.322 0 N-CA-C 108.163 -1.051 . . . . 0.0 108.163 -178.413 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 89.4 mtm-85 -86.06 138.93 31.58 Favored 'General case' 0 N--CA 1.462 0.168 0 CA-C-O 117.369 -1.3 . . . . 0.0 112.345 -178.805 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 32.2 m-85 -123.0 159.39 28.47 Favored 'General case' 0 N--CA 1.481 1.112 0 C-N-CA 127.12 2.168 . . . . 0.0 110.195 -178.62 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 1.9 m -80.75 167.72 30.48 Favored Pre-proline 0 CA--C 1.541 0.614 0 CA-C-N 119.097 0.862 . . . . 0.0 109.691 179.7 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 41.8 Cg_endo -65.25 -42.17 14.19 Favored 'Trans proline' 0 N--CA 1.459 -0.535 0 C-N-CA 121.929 1.752 . . . . 0.0 112.373 -179.653 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 77.1 t -58.39 -53.07 51.47 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.315 0 N-CA-C 108.075 -1.083 . . . . 0.0 108.075 179.757 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 -56.84 -46.03 81.98 Favored 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 124.451 1.1 . . . . 0.0 110.863 179.453 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 19.3 t70 -60.24 -50.1 75.01 Favored 'General case' 0 CA--C 1.512 -0.511 0 C-N-CA 124.072 0.949 . . . . 0.0 112.549 -179.618 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -60.24 -43.61 95.93 Favored 'General case' 0 N--CA 1.452 -0.338 0 N-CA-C 109.645 -0.502 . . . . 0.0 109.645 -179.783 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 63.1 m -58.71 -54.42 47.29 Favored 'General case' 0 N--CA 1.451 -0.385 0 N-CA-C 109.293 -0.632 . . . . 0.0 109.293 179.448 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 78.3 mt -58.14 -45.58 88.56 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.362 0 C-N-CA 123.008 0.523 . . . . 0.0 109.727 -179.673 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 29.1 ttt180 -61.65 -43.61 98.53 Favored 'General case' 0 C--N 1.334 -0.076 0 O-C-N 121.358 -0.839 . . . . 0.0 112.225 -178.941 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -68.81 -47.69 65.46 Favored 'General case' 0 CA--C 1.528 0.127 0 CA-C-N 118.915 0.78 . . . . 0.0 109.922 -179.7 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 71.8 mmtt -63.93 -46.42 84.82 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-N 118.819 0.736 . . . . 0.0 112.098 -178.885 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -60.01 -52.48 65.19 Favored 'General case' 0 N--CA 1.448 -0.549 0 C-N-CA 122.53 0.332 . . . . 0.0 110.614 -179.482 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 26.9 tp10 -62.8 -37.35 86.37 Favored 'General case' 0 N--CA 1.454 -0.263 0 CA-C-N 116.594 -0.276 . . . . 0.0 111.4 -178.646 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -63.79 -38.89 92.79 Favored 'General case' 0 CA--C 1.527 0.059 0 N-CA-C 108.685 -0.857 . . . . 0.0 108.685 179.282 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 33.1 t -75.19 -10.45 59.48 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 123.76 0.824 . . . . 0.0 110.725 178.69 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 77.77 4.02 84.7 Favored Glycine 0 CA--C 1.528 0.861 0 O-C-N 120.791 -1.193 . . . . 0.0 113.246 179.365 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 1.8 mt -118.66 115.86 25.39 Favored 'General case' 0 CA--C 1.508 -0.656 0 N-CA-C 102.685 -3.08 . . . . 0.0 102.685 179.448 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 3.1 t -46.72 160.54 0.08 Allowed 'General case' 0 C--N 1.323 -0.552 0 C-N-CA 125.615 1.566 . . . . 0.0 112.499 -179.031 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 9.2 m -47.06 -38.39 4.36 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.591 0 N-CA-C 114.13 1.159 . . . . 0.0 114.13 -177.72 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 6.9 p -66.05 -52.2 51.24 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-N 119.485 1.039 . . . . 0.0 109.898 179.153 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -56.88 -43.44 81.27 Favored 'General case' 0 CA--C 1.531 0.223 0 C-N-CA 124.185 0.994 . . . . 0.0 109.356 178.185 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 83.3 t80 -58.51 -52.28 66.32 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 124.04 0.936 . . . . 0.0 108.952 178.794 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 2.4 mm -53.39 -63.8 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.343 0.308 0 C-N-CA 126.176 1.79 . . . . 0.0 110.011 179.76 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 2.4 ptm180 -56.13 -43.02 77.8 Favored 'General case' 0 CA--C 1.516 -0.347 0 CA-C-O 117.675 -1.155 . . . . 0.0 111.637 -178.693 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 9.3 t30 -61.3 -54.71 40.51 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 119.459 1.027 . . . . 0.0 110.49 179.368 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -60.16 -32.92 71.5 Favored 'General case' 0 C--O 1.224 -0.282 0 C-N-CA 123.479 0.712 . . . . 0.0 112.157 -179.17 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -71.39 -27.04 63.04 Favored 'General case' 0 CA--C 1.535 0.382 0 N-CA-C 112.975 0.732 . . . . 0.0 112.975 -179.663 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 19.4 mt -92.48 -35.66 13.51 Favored 'General case' 0 CA--C 1.518 -0.267 0 C-N-CA 123.413 0.685 . . . . 0.0 109.81 -179.758 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 78.4 m-20 . . . . . 0 C--O 1.251 1.133 0 C-N-CA 125.334 1.454 . . . . 0.0 109.669 -180.0 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 6.4 t . . . . . 0 N--CA 1.44 -0.967 0 CA-C-O 123.237 1.494 . . . . 0.0 109.885 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 36.4 t -102.42 146.53 10.31 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.873 0 N-CA-C 101.964 -3.347 . . . . 0.0 101.964 175.004 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 9.5 p -148.14 100.0 0.37 Allowed 'Isoleucine or valine' 0 N--CA 1.442 -0.861 0 N-CA-C 102.51 -3.144 . . . . 0.0 102.51 177.254 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 46.3 ttm-85 -142.34 160.51 40.11 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.057 -0.974 . . . . 0.0 109.282 -178.77 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -108.85 122.64 47.62 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 101.278 -3.601 . . . . 0.0 101.278 178.396 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 7.5 tt -134.44 112.62 11.08 Favored 'General case' 0 N--CA 1.463 0.208 0 C-N-CA 124.609 1.163 . . . . 0.0 109.199 -177.02 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 75.1 mtm-85 -78.98 162.45 25.95 Favored 'General case' 0 N--CA 1.47 0.562 0 N-CA-C 113.52 0.933 . . . . 0.0 113.52 -178.763 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 22' ' ' PHE . . . . . . . . . . . . . 45.4 m-85 -143.05 160.75 39.78 Favored 'General case' 0 N--CA 1.47 0.549 0 C-N-CA 127.117 2.167 . . . . 0.0 107.388 179.361 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 3.1 m -88.97 173.91 5.57 Favored Pre-proline 0 CA--C 1.545 0.756 0 C-N-CA 124.692 1.197 . . . . 0.0 109.899 179.823 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 24' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -68.1 -47.47 1.72 Allowed 'Trans proline' 0 C--N 1.352 0.757 0 C-N-CA 121.687 1.591 . . . . 0.0 112.17 -178.543 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 25' ' ' VAL . . . . . . . . . . . . . 33.8 t -67.51 -31.23 51.76 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.388 0 C-N-CA 123.913 0.885 . . . . 0.0 110.296 -179.583 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 58.1 mt-10 -70.08 -48.7 56.66 Favored 'General case' 0 CA--C 1.529 0.137 0 N-CA-C 108.012 -1.107 . . . . 0.0 108.012 179.409 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 27' ' ' ASP . . . . . . . . . . . . . 23.8 t70 -60.38 -43.67 96.37 Favored 'General case' 0 C--O 1.219 -0.545 0 C-N-CA 124.968 1.307 . . . . 0.0 110.717 179.37 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 28' ' ' GLU . . . . . . . . . . . . . 12.9 tt0 -56.43 -52.2 65.54 Favored 'General case' 0 N--CA 1.454 -0.254 0 C-N-CA 124.768 1.227 . . . . 0.0 110.146 -179.696 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 4.1 m -56.71 -55.48 33.62 Favored 'General case' 0 CA--C 1.53 0.199 0 N-CA-C 109.118 -0.697 . . . . 0.0 109.118 178.96 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 73.2 mt -54.12 -50.92 51.58 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.202 0 C-N-CA 123.279 0.631 . . . . 0.0 110.845 -178.986 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 58.9 ttt180 -56.89 -48.31 78.47 Favored 'General case' 0 N--CA 1.449 -0.507 0 C-N-CA 124.587 1.155 . . . . 0.0 111.331 -178.952 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 1.9 mptm? -65.65 -45.98 80.93 Favored 'General case' 0 CA--C 1.515 -0.398 0 O-C-N 123.909 0.756 . . . . 0.0 110.379 -179.519 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 34.9 mmtt -62.47 -44.6 96.0 Favored 'General case' 0 C--N 1.333 -0.117 0 CA-C-N 119.455 1.025 . . . . 0.0 110.239 -179.02 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 34' ' ' ALA . . . . . . . . . . . . . . . -58.2 -54.61 45.05 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 124.866 1.267 . . . . 0.0 110.024 179.192 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 7.4 tp10 -66.57 -16.78 64.41 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 124.635 1.174 . . . . 0.0 112.775 -179.055 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 36' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -102.05 4.61 39.95 Favored 'General case' 0 C--N 1.327 -0.409 0 C-N-CA 126.015 1.726 . . . . 0.0 111.466 -179.899 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 37' ' ' SER . . . . . . . . . . . . . 9.1 t -127.59 -1.27 6.15 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 124.424 1.09 . . . . 0.0 112.094 179.825 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 67.79 28.72 73.45 Favored Glycine 0 CA--C 1.529 0.936 0 CA-C-N 119.876 1.216 . . . . 0.0 110.64 -178.892 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 39' ' ' LEU . . . . . . . . . . . . . 90.0 mt -120.1 125.24 47.79 Favored 'General case' 0 N--CA 1.444 -0.725 0 C-N-CA 126.041 1.736 . . . . 0.0 106.94 -179.061 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 40' ' ' THR . . . . . 0.465 HG22 ' H ' ' B' ' 43' ' ' ALA . 1.8 t -63.8 153.83 35.33 Favored 'General case' 0 CA--C 1.538 0.502 0 N-CA-C 104.703 -2.332 . . . . 0.0 104.703 176.8 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 41' ' ' VAL . . . . . . . . . . . . . 55.1 t -48.64 -38.75 10.01 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.498 0 O-C-N 121.392 -0.818 . . . . 0.0 110.261 179.071 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 42' ' ' SER . . . . . . . . . . . . . 14.4 m -62.39 -46.55 88.09 Favored 'General case' 0 CA--C 1.533 0.324 0 O-C-N 121.057 -1.027 . . . . 0.0 111.368 179.085 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 43' ' ' ALA . . . . . 0.465 ' H ' HG22 ' B' ' 40' ' ' THR . . . -64.9 -40.91 95.83 Favored 'General case' 0 C--N 1.34 0.164 0 C-N-CA 123.913 0.885 . . . . 0.0 109.23 178.803 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 44' ' ' TYR . . . . . . . . . . . . . 57.3 t80 -58.45 -50.92 71.99 Favored 'General case' 0 CA--C 1.539 0.54 0 N-CA-C 108.276 -1.009 . . . . 0.0 108.276 179.106 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 45' ' ' ILE . . . . . . . . . . . . . 12.9 mm -56.74 -61.32 1.26 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.301 0 C-N-CA 125.122 1.369 . . . . 0.0 108.609 178.807 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 46' ' ' ARG . . . . . . . . . . . . . 40.2 mtp180 -43.9 -66.01 0.43 Allowed 'General case' 0 C--O 1.219 -0.51 0 C-N-CA 126.044 1.738 . . . . 0.0 110.588 179.781 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 47' ' ' ASN . . . . . . . . . . . . . 20.5 t30 -53.25 -49.54 66.67 Favored 'General case' 0 N--CA 1.441 -0.88 0 C-N-CA 124.719 1.208 . . . . 0.0 113.601 -178.04 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -63.18 -31.62 72.81 Favored 'General case' 0 CA--C 1.535 0.399 0 CA-C-N 118.99 0.814 . . . . 0.0 111.264 179.514 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 49' ' ' ALA . . . . . . . . . . . . . . . -78.68 -16.09 57.7 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 124.067 0.947 . . . . 0.0 113.512 -179.712 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 13.9 mt -100.32 -38.02 8.63 Favored 'General case' 0 C--O 1.234 0.283 0 O-C-N 121.451 -0.781 . . . . 0.0 109.981 179.886 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 51' ' ' ASN . . . . . . . . . . . . . 43.2 m-80 . . . . . 0 C--O 1.246 0.907 0 C-N-CA 124.502 1.121 . . . . 0.0 110.136 179.155 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 12.2 t . . . . . 0 N--CA 1.436 -1.159 0 CA-C-O 124.107 1.908 . . . . 0.0 110.89 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 16.1 t -122.92 144.19 33.26 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.961 1 N-CA-C 100.072 -4.047 . . . . 0.0 100.072 176.51 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 13.1 p -136.9 102.08 2.57 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.021 0 N-CA-C 104.244 -2.502 . . . . 0.0 104.244 179.234 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 6.0 mtt-85 -128.25 158.96 36.7 Favored 'General case' 0 CA--C 1.509 -0.603 0 CA-C-O 123.103 1.43 . . . . 0.0 109.792 -179.969 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 3.7 m -94.2 83.21 4.21 Favored 'General case' 0 N--CA 1.439 -1.003 0 N-CA-C 104.049 -2.574 . . . . 0.0 104.049 -179.234 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -84.17 92.67 7.98 Favored 'General case' 0 C--N 1.325 -0.458 0 C-N-CA 124.294 1.037 . . . . 0.0 111.058 -177.771 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -74.2 146.48 43.34 Favored 'General case' 0 N--CA 1.447 -0.596 0 C-N-CA 123.961 0.904 . . . . 0.0 112.666 179.204 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 90.5 m-85 -137.11 152.29 49.83 Favored 'General case' 0 C--O 1.238 0.458 0 C-N-CA 126.624 1.97 . . . . 0.0 106.088 177.274 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 1.2 m -86.52 167.68 21.82 Favored Pre-proline 0 CA--C 1.543 0.692 0 N-CA-C 106.59 -1.633 . . . . 0.0 106.59 179.438 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -66.76 -30.84 40.73 Favored 'Trans proline' 0 CA--C 1.531 0.368 0 CA-C-N 121.201 1.465 . . . . 0.0 111.428 -179.355 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 44.8 t -69.32 -45.29 79.35 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.322 0 N-CA-C 108.456 -0.942 . . . . 0.0 108.456 179.308 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -64.37 -46.24 84.26 Favored 'General case' 0 C--O 1.224 -0.276 0 N-CA-C 109.52 -0.548 . . . . 0.0 109.52 -179.789 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -58.35 -44.21 88.66 Favored 'General case' 0 CA--C 1.513 -0.458 0 C-N-CA 123.874 0.87 . . . . 0.0 111.233 -179.772 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 15.3 tm-20 -62.24 -51.39 67.95 Favored 'General case' 0 N--CA 1.448 -0.565 0 N-CA-C 109.166 -0.679 . . . . 0.0 109.166 179.856 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 88.9 m -59.38 -53.41 58.56 Favored 'General case' 0 CA--C 1.534 0.34 0 CA-C-N 118.353 0.524 . . . . 0.0 110.009 179.482 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 83.9 mt -57.97 -43.53 85.0 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.293 0 C-N-CA 124.193 0.997 . . . . 0.0 109.861 -179.283 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 40.8 ttt180 -62.94 -42.23 99.74 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-N 119.296 0.953 . . . . 0.0 110.16 -179.63 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 4.7 mptp? -68.98 -47.71 64.91 Favored 'General case' 0 CA--C 1.515 -0.38 0 CA-C-O 118.843 -0.598 . . . . 0.0 109.864 -179.554 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 21.3 tptt -63.01 -41.1 99.48 Favored 'General case' 0 C--O 1.224 -0.27 0 CA-C-O 119.005 -0.521 . . . . 0.0 110.536 -179.488 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -61.08 -53.45 57.0 Favored 'General case' 0 N--CA 1.453 -0.294 0 C-N-CA 124.841 1.257 . . . . 0.0 109.236 179.071 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 30.5 tt0 -57.84 -44.23 86.38 Favored 'General case' 0 N--CA 1.453 -0.303 0 C-N-CA 122.966 0.507 . . . . 0.0 111.17 -179.299 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 27.0 t0 -67.33 -39.61 85.86 Favored 'General case' 0 C--N 1.332 -0.156 0 C-N-CA 123.378 0.671 . . . . 0.0 109.9 -179.85 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 22.9 t -72.3 -9.17 58.14 Favored 'General case' 0 N--CA 1.451 -0.403 0 C-N-CA 124.53 1.132 . . . . 0.0 111.007 179.66 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 65.49 29.76 75.95 Favored Glycine 0 CA--C 1.53 1.012 0 CA-C-N 119.391 0.996 . . . . 0.0 111.683 -179.682 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 71.6 mt -133.42 115.65 15.09 Favored 'General case' 0 N--CA 1.451 -0.42 0 N-CA-C 103.797 -2.668 . . . . 0.0 103.797 179.703 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 14.8 t -57.13 161.65 3.01 Favored 'General case' 0 CA--C 1.535 0.391 0 CA-C-N 119.276 0.944 . . . . 0.0 110.19 -179.843 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 97.7 t -44.19 -45.77 2.24 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.213 0 C-N-CA 126.118 1.767 . . . . 0.0 111.555 -178.812 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 2.5 p -64.19 -47.49 79.58 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-N 120.304 1.411 . . . . 0.0 112.076 -179.806 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -62.1 -44.28 97.0 Favored 'General case' 0 C--O 1.222 -0.353 0 C-N-CA 124.412 1.085 . . . . 0.0 109.176 178.69 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 61.2 t80 -59.27 -51.07 71.55 Favored 'General case' 0 N--CA 1.453 -0.322 0 C-N-CA 125.403 1.481 . . . . 0.0 108.798 179.073 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 13.8 mm -55.19 -60.32 1.73 Allowed 'Isoleucine or valine' 0 C--O 1.226 -0.132 0 C-N-CA 124.408 1.083 . . . . 0.0 110.163 179.705 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 21.2 ptt180 -59.93 -44.64 94.21 Favored 'General case' 0 C--O 1.219 -0.524 0 CA-C-O 118.366 -0.826 . . . . 0.0 110.499 -179.2 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 18.0 t30 -53.57 -56.73 14.6 Favored 'General case' 0 CA--C 1.519 -0.215 0 CA-C-N 119.374 0.988 . . . . 0.0 110.079 179.875 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -61.42 -33.13 73.19 Favored 'General case' 0 N--CA 1.453 -0.284 0 C-N-CA 124.174 0.99 . . . . 0.0 112.245 -179.81 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -75.5 -24.42 56.85 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 123.441 0.696 . . . . 0.0 112.874 -179.588 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 11.8 mt -98.55 -29.19 13.22 Favored 'General case' 0 N--CA 1.465 0.298 0 C-N-CA 123.583 0.753 . . . . 0.0 111.325 -179.399 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 43.3 m-80 . . . . . 0 C--O 1.243 0.75 0 C-N-CA 126.655 1.982 . . . . 0.0 108.378 -179.846 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 4.5 t . . . . . 0 N--CA 1.442 -0.841 0 N-CA-C 108.852 -0.796 . . . . 0.0 108.852 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 21.4 t -105.56 120.28 56.1 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.53 0 N-CA-C 104.58 -2.378 . . . . 0.0 104.58 178.674 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 9.4 p -115.59 90.7 1.58 Allowed 'Isoleucine or valine' 0 N--CA 1.447 -0.6 0 N-CA-C 106.233 -1.766 . . . . 0.0 106.233 178.717 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -117.77 161.64 19.37 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 114.234 -1.348 . . . . 0.0 109.185 -179.857 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 56.3 m -104.99 88.68 2.93 Favored 'General case' 0 N--CA 1.448 -0.526 0 N-CA-C 105.155 -2.165 . . . . 0.0 105.155 -179.654 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -90.7 105.6 17.94 Favored 'General case' 0 C--N 1.324 -0.514 0 C-N-CA 125.612 1.565 . . . . 0.0 110.894 -178.47 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 1.4 mpp_? -82.55 154.07 25.21 Favored 'General case' 0 N--CA 1.455 -0.216 0 C-N-CA 123.548 0.739 . . . . 0.0 111.555 178.847 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 22' ' ' PHE . . . . . . . . . . . . . 81.7 m-85 -138.35 141.69 39.7 Favored 'General case' 0 CA--C 1.516 -0.342 0 N-CA-C 106.624 -1.621 . . . . 0.0 106.624 178.129 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 14.5 m -71.61 165.76 46.12 Favored Pre-proline 0 CA--C 1.539 0.556 0 N-CA-C 109.318 -0.623 . . . . 0.0 109.318 179.653 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 24' ' ' PRO . . . . . . . . . . . . . 33.9 Cg_endo -62.36 -38.52 53.04 Favored 'Trans proline' 0 C--N 1.348 0.529 0 C-N-CA 121.457 1.438 . . . . 0.0 111.145 -179.4 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 25' ' ' VAL . . . . . . . . . . . . . 60.5 t -65.42 -49.39 78.71 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.254 0 C-N-CA 124.433 1.093 . . . . 0.0 109.346 179.41 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 54.8 mt-10 -58.96 -49.33 78.26 Favored 'General case' 0 C--O 1.223 -0.335 0 C-N-CA 124.097 0.959 . . . . 0.0 109.743 -179.716 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 27' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -59.83 -39.04 83.73 Favored 'General case' 0 N--CA 1.453 -0.306 0 C-N-CA 124.753 1.221 . . . . 0.0 111.771 -179.832 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 28' ' ' GLU . . . . . . . . . . . . . 12.4 tt0 -66.61 -53.33 35.44 Favored 'General case' 0 N--CA 1.453 -0.315 0 N-CA-C 109.231 -0.655 . . . . 0.0 109.231 179.551 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 64.8 m -57.63 -50.58 72.67 Favored 'General case' 0 N--CA 1.454 -0.251 0 C-N-CA 124.064 0.945 . . . . 0.0 110.02 179.438 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 81.3 mt -60.78 -42.93 94.12 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.354 0 C-N-CA 123.564 0.746 . . . . 0.0 109.275 -179.676 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 56.8 ttt180 -61.42 -51.01 70.52 Favored 'General case' 0 CA--C 1.519 -0.213 0 CA-C-N 119.296 0.953 . . . . 0.0 110.211 179.261 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 5.0 mptp? -60.77 -44.16 97.11 Favored 'General case' 0 CA--C 1.52 -0.195 0 CA-C-N 118.371 0.532 . . . . 0.0 110.388 -179.293 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 34.4 tptt -68.81 -38.99 80.29 Favored 'General case' 0 CA--C 1.528 0.129 0 CA-C-N 118.865 0.757 . . . . 0.0 111.088 -179.631 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 34' ' ' ALA . . . . . . . . . . . . . . . -65.81 -36.25 82.97 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-O 122.577 1.18 . . . . 0.0 109.348 178.825 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 20.6 tt0 -75.7 -19.39 59.14 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 124.137 0.975 . . . . 0.0 110.294 179.433 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 36' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -86.19 -45.55 11.22 Favored 'General case' 0 C--O 1.232 0.169 0 C-N-CA 125.561 1.544 . . . . 0.0 109.856 179.109 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 37' ' ' SER . . . . . . . . . . . . . 48.0 t -79.16 -10.96 59.96 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-O 118.787 -0.625 . . . . 0.0 109.914 -179.911 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 82.39 -7.69 63.75 Favored Glycine 0 C--N 1.338 0.685 0 C-N-CA 124.975 1.274 . . . . 0.0 115.165 178.227 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 39' ' ' LEU . . . . . . . . . . . . . 13.8 mt -96.44 125.48 40.96 Favored 'General case' 0 CA--C 1.518 -0.253 0 CA-C-N 120.235 2.017 . . . . 0.0 105.85 -179.519 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 40' ' ' THR . . . . . . . . . . . . . 5.3 t -45.85 151.32 0.46 Allowed 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 125.202 1.401 . . . . 0.0 110.497 179.851 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 41' ' ' VAL . . . . . . . . . . . . . 53.3 t -45.73 -46.41 4.93 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.218 0 C-N-CA 125.307 1.443 . . . . 0.0 111.772 -179.047 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 42' ' ' SER . . . . . . . . . . . . . 9.6 p -55.55 -45.38 77.27 Favored 'General case' 0 C--O 1.235 0.291 0 O-C-N 121.747 -0.596 . . . . 0.0 112.188 -179.967 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -70.23 -46.74 63.86 Favored 'General case' 0 C--O 1.222 -0.391 0 C-N-CA 124.582 1.153 . . . . 0.0 108.854 178.936 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 44' ' ' TYR . . . . . . . . . . . . . 38.8 t80 -49.61 -50.58 42.23 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 124.626 1.17 . . . . 0.0 109.08 179.662 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 45' ' ' ILE . . . . . . . . . . . . . 21.6 mm -54.44 -61.19 1.04 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.421 0 C-N-CA 124.085 0.954 . . . . 0.0 111.395 179.457 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 46' ' ' ARG . . . . . . . . . . . . . 12.1 ptm180 -59.91 -43.97 94.56 Favored 'General case' 0 N--CA 1.467 0.396 0 O-C-N 121.736 -0.602 . . . . 0.0 111.704 -178.766 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 47' ' ' ASN . . . . . . . . . . . . . 20.6 t30 -56.95 -57.16 13.73 Favored 'General case' 0 N--CA 1.449 -0.509 0 C-N-CA 124.392 1.077 . . . . 0.0 110.76 -179.113 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -61.95 -33.41 74.23 Favored 'General case' 0 N--CA 1.453 -0.281 0 C-N-CA 124.404 1.081 . . . . 0.0 111.708 -179.968 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 49' ' ' ALA . . . . . . . . . . . . . . . -68.56 -42.24 78.64 Favored 'General case' 0 N--CA 1.451 -0.376 0 O-C-N 121.703 -0.623 . . . . 0.0 112.114 -179.11 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 12.5 mt -80.46 -36.03 34.08 Favored 'General case' 0 C--N 1.328 -0.362 0 C-N-CA 123.115 0.566 . . . . 0.0 112.061 -178.844 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 51' ' ' ASN . . . . . . . . . . . . . 46.7 m-80 . . . . . 0 C--O 1.248 1.0 0 CA-C-O 117.362 -1.304 . . . . 0.0 109.769 -179.077 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 14.6 t . . . . . 0 N--CA 1.446 -0.674 0 N-CA-C 107.048 -1.464 . . . . 0.0 107.048 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 36.2 t -119.56 129.31 75.49 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.672 0 N-CA-C 104.108 -2.553 . . . . 0.0 104.108 178.92 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 14.3 p -122.0 98.97 6.35 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.515 0 N-CA-C 102.842 -3.021 . . . . 0.0 102.842 178.202 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 62.4 mtt-85 -140.42 164.9 28.88 Favored 'General case' 0 CA--C 1.51 -0.565 0 CA-C-N 115.021 -0.99 . . . . 0.0 110.119 -179.279 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -110.39 148.76 31.37 Favored 'General case' 0 N--CA 1.444 -0.73 0 C-N-CA 125.216 1.406 . . . . 0.0 107.615 179.272 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 58.2 mt -145.09 112.87 6.33 Favored 'General case' 0 CA--C 1.51 -0.558 0 N-CA-C 107.228 -1.397 . . . . 0.0 107.228 178.749 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 14.8 mtm180 -86.42 152.17 22.92 Favored 'General case' 0 C--O 1.238 0.492 0 N-CA-C 107.416 -1.327 . . . . 0.0 107.416 178.052 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 87.7 m-85 -132.8 140.08 47.83 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 105.415 -2.069 . . . . 0.0 105.415 179.58 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -66.76 173.15 2.66 Favored Pre-proline 0 CA--C 1.552 1.037 0 CA-C-N 119.324 0.965 . . . . 0.0 109.53 -179.841 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 28.9 Cg_endo -63.44 -42.29 22.42 Favored 'Trans proline' 0 C--N 1.348 0.517 0 C-N-CA 121.845 1.697 . . . . 0.0 112.983 -178.029 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 38.4 t -67.11 -40.05 84.51 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.306 0 C-N-CA 123.613 0.765 . . . . 0.0 109.653 -179.995 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 -66.26 -44.18 84.35 Favored 'General case' 0 CA--C 1.521 -0.171 0 C-N-CA 124.94 1.296 . . . . 0.0 111.089 -178.791 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 34.5 t70 -61.88 -49.11 77.54 Favored 'General case' 0 CA--C 1.502 -0.89 0 N-CA-C 108.289 -1.004 . . . . 0.0 108.289 179.22 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 44.8 tt0 -52.52 -43.77 65.33 Favored 'General case' 0 N--CA 1.445 -0.714 0 CA-C-O 118.325 -0.845 . . . . 0.0 110.941 179.945 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 32.4 m -65.92 -54.92 20.15 Favored 'General case' 0 CA--C 1.529 0.154 0 CA-C-N 118.837 0.744 . . . . 0.0 109.631 179.185 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 79.9 mt -63.11 -25.6 38.92 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.325 0 CA-C-O 121.724 0.773 . . . . 0.0 111.784 -178.661 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 42.2 ttt180 -77.84 -45.46 24.26 Favored 'General case' 0 C--N 1.316 -0.882 0 O-C-N 119.826 -1.796 . . . . 0.0 107.582 179.526 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 5.6 mptt -68.47 -47.28 67.53 Favored 'General case' 0 CA--C 1.519 -0.22 0 CA-C-O 118.167 -0.92 . . . . 0.0 112.78 179.879 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 29.3 tptt -67.97 -33.67 75.09 Favored 'General case' 0 CA--C 1.523 -0.081 0 CA-C-N 120.407 1.458 . . . . 0.0 111.746 -177.941 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -67.13 -54.88 17.17 Favored 'General case' 0 C--N 1.331 -0.207 0 C-N-CA 125.249 1.42 . . . . 0.0 108.212 179.599 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 22.7 tt0 -60.13 -39.99 88.22 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-N 115.48 -0.782 . . . . 0.0 111.213 -179.143 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -64.95 -41.25 95.66 Favored 'General case' 0 N--CA 1.462 0.126 0 C-N-CA 124.857 1.263 . . . . 0.0 109.984 179.111 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 35.7 m -79.57 -9.05 59.56 Favored 'General case' 0 N--CA 1.448 -0.574 0 C-N-CA 123.741 0.817 . . . . 0.0 112.706 -179.388 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 75.15 13.56 82.63 Favored Glycine 0 CA--C 1.531 1.045 0 CA-C-N 119.377 0.99 . . . . 0.0 113.508 -179.972 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 13.0 mt -115.77 116.43 28.03 Favored 'General case' 0 CA--C 1.511 -0.549 0 N-CA-C 104.379 -2.452 . . . . 0.0 104.379 179.047 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 9.9 t -53.47 157.39 2.11 Favored 'General case' 0 CA--C 1.537 0.449 0 N-CA-C 109.486 -0.561 . . . . 0.0 109.486 179.062 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 61.0 t -45.62 -43.86 4.08 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.206 0 C-N-CA 125.223 1.409 . . . . 0.0 111.551 -179.457 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 97.7 p -59.68 -50.36 74.16 Favored 'General case' 0 CA--C 1.545 0.752 0 CA-C-N 119.44 1.018 . . . . 0.0 111.206 -179.42 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.5 -42.55 98.5 Favored 'General case' 0 C--N 1.339 0.126 0 C-N-CA 124.302 1.041 . . . . 0.0 109.743 179.161 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 67.9 t80 -57.46 -53.33 59.42 Favored 'General case' 0 N--CA 1.45 -0.467 0 N-CA-C 109.335 -0.617 . . . . 0.0 109.335 179.211 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 23.3 mm -54.13 -54.83 17.84 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.152 0 C-N-CA 124.269 1.027 . . . . 0.0 111.372 -179.292 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 13.2 ptt180 -60.78 -50.84 71.83 Favored 'General case' 0 N--CA 1.464 0.266 0 O-C-N 121.609 -0.682 . . . . 0.0 111.397 -179.615 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 22.9 t30 -55.41 -58.37 8.04 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 118.667 -0.682 . . . . 0.0 110.463 -179.562 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -57.14 -31.97 65.89 Favored 'General case' 0 N--CA 1.456 -0.138 0 C-N-CA 124.106 0.963 . . . . 0.0 113.297 -178.934 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -79.81 -33.21 40.61 Favored 'General case' 0 CA--C 1.531 0.248 0 N-CA-C 114.396 1.258 . . . . 0.0 114.396 -179.18 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 13.8 mt -82.98 -33.42 26.62 Favored 'General case' 0 N--CA 1.47 0.53 0 CA-C-N 118.5 0.591 . . . . 0.0 111.316 -178.988 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 3.4 m-80 . . . . . 0 C--O 1.249 1.028 0 C-N-CA 124.646 1.179 . . . . 0.0 108.335 179.107 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 12.4 t . . . . . 0 N--CA 1.441 -0.883 0 N-CA-C 107.35 -1.352 . . . . 0.0 107.35 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 21.1 t -138.11 152.85 26.32 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.516 0 N-CA-C 106.762 -1.57 . . . . 0.0 106.762 -179.905 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 9.8 p -141.62 104.19 1.3 Allowed 'Isoleucine or valine' 0 N--CA 1.441 -0.891 0 N-CA-C 104.46 -2.422 . . . . 0.0 104.46 177.795 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 30.2 mtt-85 -149.66 152.98 36.28 Favored 'General case' 0 CA--C 1.517 -0.31 0 O-C-N 121.708 -0.62 . . . . 0.0 110.636 -179.323 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 2.3 m -100.36 145.13 28.54 Favored 'General case' 0 C--N 1.327 -0.412 0 C-N-CA 124.909 1.283 . . . . 0.0 108.584 -179.515 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 61.3 mt -134.79 112.84 11.05 Favored 'General case' 0 CA--C 1.52 -0.183 0 N-CA-C 107.699 -1.223 . . . . 0.0 107.699 178.871 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 21.8 mmm-85 -82.52 118.16 23.05 Favored 'General case' 0 C--O 1.233 0.234 0 C-N-CA 124.56 1.144 . . . . 0.0 108.747 179.706 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 22' ' ' PHE . . . . . . . . . . . . . 96.7 m-85 -113.55 155.71 24.92 Favored 'General case' 0 N--CA 1.475 0.808 0 CA-C-N 119.725 1.148 . . . . 0.0 108.421 179.427 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -85.91 168.17 20.75 Favored Pre-proline 0 CA--C 1.541 0.619 0 N-CA-C 107.607 -1.257 . . . . 0.0 107.607 179.509 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 24' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_endo -62.77 -33.21 77.08 Favored 'Trans proline' 0 N--CA 1.459 -0.504 0 C-N-CA 121.611 1.54 . . . . 0.0 112.868 -178.835 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 25' ' ' VAL . . . . . . . . . . . . . 26.3 t -68.25 -57.0 10.57 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.187 0 C-N-CA 124.154 0.982 . . . . 0.0 108.907 179.566 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 2.4 mp0 -55.29 -42.5 73.7 Favored 'General case' 0 CA--C 1.529 0.143 0 C-N-CA 123.568 0.747 . . . . 0.0 110.972 -179.703 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 27' ' ' ASP . . . . . . . . . . . . . 5.0 t70 -63.47 -44.66 93.79 Favored 'General case' 0 C--O 1.224 -0.282 0 C-N-CA 123.476 0.71 . . . . 0.0 109.956 178.776 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 28' ' ' GLU . . . . . . . . . . . . . 19.1 tt0 -58.5 -49.06 78.75 Favored 'General case' 0 N--CA 1.45 -0.464 0 N-CA-C 109.285 -0.635 . . . . 0.0 109.285 179.762 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 88.4 m -58.9 -54.68 44.34 Favored 'General case' 0 N--CA 1.452 -0.362 0 C-N-CA 124.835 1.254 . . . . 0.0 109.686 179.816 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 63.8 mt -59.59 -44.98 94.49 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.132 0 CA-C-N 118.302 0.501 . . . . 0.0 110.461 -179.54 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 77.0 ttt180 -59.08 -47.86 83.71 Favored 'General case' 0 C--O 1.235 0.32 0 C-N-CA 123.4 0.68 . . . . 0.0 110.75 -179.14 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 9.2 mptt -62.85 -50.44 70.93 Favored 'General case' 0 CA--C 1.512 -0.494 0 O-C-N 123.812 0.695 . . . . 0.0 109.621 179.27 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 9.1 tptt -62.23 -38.83 90.71 Favored 'General case' 0 CA--C 1.516 -0.349 0 CA-C-O 118.609 -0.71 . . . . 0.0 112.322 -177.858 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 34' ' ' ALA . . . . . . . . . . . . . . . -58.47 -52.73 64.38 Favored 'General case' 0 N--CA 1.45 -0.439 0 N-CA-C 108.251 -1.018 . . . . 0.0 108.251 178.47 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 11.7 tt0 -68.01 -34.98 77.53 Favored 'General case' 0 CA--C 1.533 0.322 0 N-CA-C 113.003 0.742 . . . . 0.0 113.003 -178.853 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 36' ' ' ASP . . . . . . . . . . . . . 30.3 t70 -65.03 -40.78 95.35 Favored 'General case' 0 C--N 1.332 -0.18 0 C-N-CA 125.122 1.369 . . . . 0.0 108.847 179.389 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 37' ' ' SER . . . . . . . . . . . . . 72.4 m -79.77 -12.89 59.76 Favored 'General case' 0 N--CA 1.45 -0.435 0 C-N-CA 123.09 0.556 . . . . 0.0 110.58 178.459 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 79.07 23.55 63.39 Favored Glycine 0 CA--C 1.523 0.589 0 CA-C-O 118.219 -1.323 . . . . 0.0 114.716 179.012 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 39' ' ' LEU . . . . . . . . . . . . . 33.4 mt -122.55 147.49 46.32 Favored 'General case' 0 N--CA 1.455 -0.213 0 CA-C-N 119.898 1.849 . . . . 0.0 106.106 179.225 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 40' ' ' THR . . . . . . . . . . . . . 5.5 t -64.31 152.46 41.08 Favored 'General case' 0 C--N 1.324 -0.509 0 O-C-N 120.959 -1.088 . . . . 0.0 108.251 179.298 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 41' ' ' VAL . . . . . . . . . . . . . 42.0 t -49.94 -44.84 21.84 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.353 0 O-C-N 121.242 -0.911 . . . . 0.0 110.691 179.399 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 42' ' ' SER . . . . . . . . . . . . . 3.7 p -59.74 -35.6 74.91 Favored 'General case' 0 CA--C 1.542 0.645 0 O-C-N 121.178 -0.951 . . . . 0.0 111.776 -179.863 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -75.93 -43.16 46.33 Favored 'General case' 0 C--O 1.22 -0.489 0 C-N-CA 124.186 0.994 . . . . 0.0 108.595 178.465 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 44' ' ' TYR . . . . . . . . . . . . . 56.3 t80 -55.54 -48.02 75.38 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 124.098 0.959 . . . . 0.0 108.744 178.927 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 45' ' ' ILE . . . . . . . . . . . . . 26.0 mm -61.32 -55.9 21.47 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.151 0 C-N-CA 123.718 0.807 . . . . 0.0 111.72 179.747 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 46' ' ' ARG . . . . . . . . . . . . . 21.0 ptt180 -59.13 -44.04 92.02 Favored 'General case' 0 C--O 1.222 -0.348 0 CA-C-N 118.863 0.756 . . . . 0.0 109.764 -179.259 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 47' ' ' ASN . . . . . . . . . . . . . 15.3 t30 -56.51 -59.65 4.68 Favored 'General case' 0 N--CA 1.451 -0.399 0 C-N-CA 124.24 1.016 . . . . 0.0 110.714 179.916 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -58.58 -31.58 68.15 Favored 'General case' 0 CA--C 1.529 0.158 0 N-CA-C 113.456 0.91 . . . . 0.0 113.456 -178.767 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 49' ' ' ALA . . . . . . . . . . . . . . . -78.91 -34.7 44.43 Favored 'General case' 0 N--CA 1.452 -0.357 0 N-CA-C 113.773 1.027 . . . . 0.0 113.773 -179.368 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 30.7 mt -81.23 -35.15 31.6 Favored 'General case' 0 C--N 1.329 -0.316 0 O-C-N 121.59 -0.694 . . . . 0.0 112.408 -178.976 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 51' ' ' ASN . . . . . . . . . . . . . 35.7 m-80 . . . . . 0 C--O 1.252 1.221 0 CA-C-O 115.936 -1.983 . . . . 0.0 114.86 -179.329 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 2.8 t . . . . . 0 N--CA 1.433 -1.283 0 N-CA-C 109.079 -0.712 . . . . 0.0 109.079 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 16.0 t -141.74 150.12 19.59 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.53 0 N-CA-C 104.08 -2.563 . . . . 0.0 104.08 178.161 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 14.6 p -145.19 113.94 1.52 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.491 0 N-CA-C 106.677 -1.601 . . . . 0.0 106.677 178.39 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 60.4 ttt-85 -147.83 161.94 40.25 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 106.783 -1.562 . . . . 0.0 106.783 179.465 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -92.99 133.55 36.02 Favored 'General case' 0 N--CA 1.442 -0.834 0 N-CA-C 104.688 -2.338 . . . . 0.0 104.688 178.056 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -115.6 159.33 21.44 Favored 'General case' 0 C--O 1.238 0.488 0 N-CA-C 105.673 -1.973 . . . . 0.0 105.673 178.34 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 17.4 mmt85 -128.91 150.18 50.47 Favored 'General case' 0 CA--C 1.512 -0.505 0 C-N-CA 124.055 0.942 . . . . 0.0 109.565 -179.759 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 90.0 m-85 -142.3 149.83 40.03 Favored 'General case' 0 CA--C 1.515 -0.379 0 N-CA-C 107.568 -1.271 . . . . 0.0 107.568 179.106 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 2.0 m -85.67 -175.62 0.65 Allowed Pre-proline 0 CA--C 1.55 0.965 0 C-N-CA 125.021 1.328 . . . . 0.0 111.091 -179.109 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 39.4 Cg_endo -65.7 -55.06 0.47 Allowed 'Trans proline' 0 C--N 1.357 1.004 0 CA-C-N 121.94 1.729 . . . . 0.0 110.879 -179.485 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 59.9 t -62.0 -40.8 88.61 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.291 0 C-N-CA 123.11 0.564 . . . . 0.0 110.393 -179.772 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -58.46 -50.94 71.92 Favored 'General case' 0 C--O 1.228 -0.051 0 CA-C-N 118.376 0.535 . . . . 0.0 111.597 -179.048 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -65.09 -46.0 82.91 Favored 'General case' 0 CA--C 1.51 -0.563 0 C-N-CA 122.724 0.41 . . . . 0.0 111.311 -179.958 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 39.8 tt0 -54.12 -52.69 60.24 Favored 'General case' 0 N--CA 1.445 -0.708 0 C-N-CA 124.366 1.066 . . . . 0.0 109.69 -179.862 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 22.6 m -63.37 -54.03 43.2 Favored 'General case' 0 N--CA 1.449 -0.493 0 C-N-CA 124.309 1.043 . . . . 0.0 111.034 -179.786 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 34.0 mt -55.55 -44.72 77.46 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.243 0 CA-C-N 118.399 0.545 . . . . 0.0 110.396 -179.331 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 70.1 ttt-85 -62.56 -45.26 93.75 Favored 'General case' 0 C--N 1.33 -0.281 0 C-N-CA 123.179 0.592 . . . . 0.0 110.478 -179.75 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 4.2 mptp? -62.52 -49.21 76.25 Favored 'General case' 0 CA--C 1.517 -0.298 0 C-N-CA 123.085 0.554 . . . . 0.0 109.979 -179.608 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 30.7 tptt -62.12 -50.92 69.97 Favored 'General case' 0 N--CA 1.448 -0.56 0 C-N-CA 122.72 0.408 . . . . 0.0 109.954 -179.331 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -57.0 -47.3 81.15 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 123.824 0.85 . . . . 0.0 111.942 -178.721 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 19.9 tt0 -68.71 -22.46 64.35 Favored 'General case' 0 C--O 1.236 0.394 0 O-C-N 121.147 -0.971 . . . . 0.0 111.018 -179.391 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 24.0 t0 -87.9 -35.73 17.54 Favored 'General case' 0 CA--C 1.522 -0.106 0 C-N-CA 123.635 0.774 . . . . 0.0 110.452 -179.574 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 3.8 t -85.96 -11.43 53.08 Favored 'General case' 0 CA--C 1.536 0.416 0 O-C-N 121.351 -0.843 . . . . 0.0 110.345 179.088 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 86.44 -14.59 54.39 Favored Glycine 0 CA--C 1.527 0.82 0 C-N-CA 125.664 1.602 . . . . 0.0 112.453 -179.669 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 72.2 mt -75.31 112.06 11.21 Favored 'General case' 0 CA--C 1.506 -0.729 0 N-CA-C 105.098 -2.186 . . . . 0.0 105.098 -179.616 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 1.7 t -49.21 152.57 1.15 Allowed 'General case' 0 CA--C 1.538 0.505 0 N-CA-C 108.448 -0.945 . . . . 0.0 108.448 178.645 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 24.3 t -46.5 -35.57 2.61 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.418 0 C-N-CA 125.448 1.499 . . . . 0.0 112.063 -179.326 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -70.84 -47.82 57.27 Favored 'General case' 0 CA--C 1.539 0.535 0 O-C-N 121.337 -0.852 . . . . 0.0 110.325 178.058 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -61.75 -43.3 99.12 Favored 'General case' 0 C--O 1.224 -0.243 0 C-N-CA 124.73 1.212 . . . . 0.0 110.126 179.131 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 61.7 t80 -54.41 -52.89 60.32 Favored 'General case' 0 N--CA 1.449 -0.511 0 C-N-CA 125.247 1.419 . . . . 0.0 109.289 179.658 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 20.8 mm -56.55 -60.15 2.22 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.209 0 C-N-CA 123.306 0.642 . . . . 0.0 112.439 179.657 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 11.8 ptm180 -57.27 -44.45 83.96 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-N 118.277 0.49 . . . . 0.0 111.3 -178.775 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 22.8 t30 -57.91 -53.7 55.23 Favored 'General case' 0 N--CA 1.455 -0.221 0 C-N-CA 123.722 0.809 . . . . 0.0 112.019 -179.508 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -62.45 -34.16 76.25 Favored 'General case' 0 C--N 1.334 -0.074 0 N-CA-C 113.017 0.747 . . . . 0.0 113.017 -179.435 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -70.7 -41.82 71.47 Favored 'General case' 0 N--CA 1.448 -0.525 0 N-CA-C 111.971 0.36 . . . . 0.0 111.971 -178.719 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 17.6 mt -74.58 -40.96 61.3 Favored 'General case' 0 CA--C 1.513 -0.452 0 C-N-CA 123.028 0.531 . . . . 0.0 112.098 -178.623 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 43.8 m-80 . . . . . 0 C--O 1.252 1.221 0 O-C-N 124.194 0.934 . . . . 0.0 108.621 179.765 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 6.9 t . . . . . 0 N--CA 1.432 -1.327 0 CA-C-O 121.845 0.831 . . . . 0.0 111.077 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 36.1 t -136.67 145.11 30.83 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.426 0 N-CA-C 104.225 -2.509 . . . . 0.0 104.225 178.856 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 12.3 p -130.93 112.57 22.37 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.697 0 N-CA-C 104.938 -2.245 . . . . 0.0 104.938 178.923 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 4.4 ttt-85 -142.84 146.75 34.44 Favored 'General case' 0 CA--C 1.51 -0.584 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.804 -179.646 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 87.4 m -93.34 117.96 30.71 Favored 'General case' 0 C--O 1.239 0.514 0 N-CA-C 104.715 -2.328 . . . . 0.0 104.715 178.391 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 14.6 tp -120.38 138.54 53.69 Favored 'General case' 0 C--O 1.236 0.395 0 C-N-CA 124.434 1.094 . . . . 0.0 108.869 -178.742 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 11.2 mtt85 -116.15 161.32 19.11 Favored 'General case' 0 CA--C 1.519 -0.24 0 C-N-CA 124.142 0.977 . . . . 0.0 111.562 -179.177 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 22' ' ' PHE . . . . . . . . . . . . . 82.1 m-85 -143.83 157.64 44.23 Favored 'General case' 0 C--N 1.33 -0.258 0 C-N-CA 125.298 1.439 . . . . 0.0 108.019 -179.839 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 50.3 m -79.94 170.44 15.84 Favored Pre-proline 0 CA--C 1.548 0.89 0 C-N-CA 125.241 1.416 . . . . 0.0 107.369 178.344 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 24' ' ' PRO . . . . . . . . . . . . . 60.8 Cg_endo -69.12 -42.82 3.68 Favored 'Trans proline' 0 C--N 1.347 0.448 0 CA-C-N 121.345 1.516 . . . . 0.0 111.063 -178.868 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 25' ' ' VAL . . . . . . . . . . . . . 4.2 t -60.84 -39.16 80.97 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.475 0 C-N-CA 124.013 0.925 . . . . 0.0 108.916 179.762 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 81.3 mt-10 -69.46 -49.78 51.75 Favored 'General case' 0 C--O 1.22 -0.497 0 C-N-CA 123.55 0.74 . . . . 0.0 109.783 179.685 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 27' ' ' ASP . . . . . . . . . . . . . 2.6 t70 -56.09 -43.29 77.9 Favored 'General case' 0 CA--C 1.513 -0.448 0 C-N-CA 124.559 1.144 . . . . 0.0 111.477 179.635 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 28' ' ' GLU . . . . . . . . . . . . . 34.8 tt0 -65.09 -50.44 66.1 Favored 'General case' 0 N--CA 1.445 -0.724 0 O-C-N 123.927 0.767 . . . . 0.0 108.946 179.773 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 60.5 m -58.68 -51.78 68.48 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 122.979 0.512 . . . . 0.0 109.66 179.692 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 83.9 mt -58.45 -43.8 87.5 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.23 0 C-N-CA 124.337 1.055 . . . . 0.0 109.546 -179.803 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 64.9 ttt180 -62.82 -49.57 74.41 Favored 'General case' 0 CA--C 1.519 -0.223 0 O-C-N 121.587 -0.695 . . . . 0.0 110.005 179.737 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 5.1 mptp? -62.28 -42.99 99.82 Favored 'General case' 0 N--CA 1.454 -0.242 0 CA-C-O 118.044 -0.979 . . . . 0.0 110.408 -179.741 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 34.7 tptt -70.37 -37.74 74.63 Favored 'General case' 0 CA--C 1.521 -0.135 0 CA-C-N 119.715 1.143 . . . . 0.0 111.369 -179.413 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 34' ' ' ALA . . . . . . . . . . . . . . . -60.82 -49.12 78.76 Favored 'General case' 0 N--CA 1.453 -0.303 0 N-CA-C 107.259 -1.385 . . . . 0.0 107.259 177.999 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 67.9 tt0 -60.7 -44.64 96.32 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 124.233 1.013 . . . . 0.0 110.863 179.85 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 36' ' ' ASP . . . . . . . . . . . . . 20.8 t70 -62.19 -41.73 98.61 Favored 'General case' 0 CA--C 1.519 -0.214 0 C-N-CA 126.781 2.033 . . . . 0.0 110.19 -179.436 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 37' ' ' SER . . . . . . . . . . . . . 8.0 t -82.16 -10.44 59.17 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 123.058 0.543 . . . . 0.0 111.159 179.527 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 71.41 10.95 71.24 Favored Glycine 0 CA--C 1.533 1.17 0 O-C-N 120.776 -1.203 . . . . 0.0 111.302 -178.761 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 39' ' ' LEU . . . . . . . . . . . . . 27.2 mt -107.07 112.63 25.64 Favored 'General case' 0 N--CA 1.451 -0.399 0 C-N-CA 126.486 1.914 . . . . 0.0 106.173 -179.93 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 40' ' ' THR . . . . . . . . . . . . . 6.4 t -45.51 153.78 0.23 Allowed 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 125.957 1.703 . . . . 0.0 110.156 179.476 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 41' ' ' VAL . . . . . . . . . . . . . 89.4 t -45.62 -45.41 4.49 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.246 0 C-N-CA 124.621 1.168 . . . . 0.0 111.686 -178.683 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 42' ' ' SER . . . . . . . . . . . . . 4.3 p -63.64 -42.92 98.09 Favored 'General case' 0 CA--C 1.541 0.628 0 O-C-N 121.117 -0.989 . . . . 0.0 112.063 179.597 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -65.26 -43.42 91.36 Favored 'General case' 0 C--N 1.34 0.157 0 C-N-CA 125.03 1.332 . . . . 0.0 109.193 178.956 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 44' ' ' TYR . . . . . . . . . . . . . 84.8 t80 -58.1 -52.28 66.21 Favored 'General case' 0 N--CA 1.448 -0.527 0 C-N-CA 125.26 1.424 . . . . 0.0 108.497 179.298 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 45' ' ' ILE . . . . . . . . . . . . . 16.8 mm -57.51 -62.61 0.87 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.393 0 C-N-CA 123.961 0.904 . . . . 0.0 111.261 179.81 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 46' ' ' ARG . . . . . . . . . . . . . 9.0 ptm180 -53.59 -41.17 66.31 Favored 'General case' 0 C--O 1.224 -0.287 0 CA-C-O 118.057 -0.973 . . . . 0.0 112.558 -178.664 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 47' ' ' ASN . . . . . . . . . . . . . 16.1 t30 -70.62 -52.2 22.96 Favored 'General case' 0 N--CA 1.453 -0.321 0 C-N-CA 124.502 1.121 . . . . 0.0 111.187 -179.348 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -58.4 -31.45 67.71 Favored 'General case' 0 CA--C 1.53 0.178 0 C-N-CA 122.908 0.483 . . . . 0.0 112.016 -179.175 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 49' ' ' ALA . . . . . . . . . . . . . . . -74.83 -21.05 59.5 Favored 'General case' 0 N--CA 1.445 -0.686 0 N-CA-C 114.761 1.393 . . . . 0.0 114.761 -179.476 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 10.8 mt -105.38 -34.84 7.71 Favored 'General case' 0 N--CA 1.469 0.52 0 N-CA-C 113.757 1.021 . . . . 0.0 113.757 -178.391 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 51' ' ' ASN . . . . . . . . . . . . . 26.3 m-80 . . . . . 0 C--O 1.252 1.232 0 CA-C-O 116.214 -1.85 . . . . 0.0 113.528 -178.307 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 11.4 t . . . . . 0 N--CA 1.439 -1.025 0 N-CA-C 107.305 -1.369 . . . . 0.0 107.305 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 2.3 p -80.2 148.8 5.49 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.01 0 N-CA-C 105.515 -2.032 . . . . 0.0 105.515 178.245 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 13.1 p -144.81 114.0 1.68 Allowed 'Isoleucine or valine' 0 N--CA 1.441 -0.914 0 N-CA-C 107.541 -1.281 . . . . 0.0 107.541 177.692 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 17.0 ttt85 -145.47 177.72 8.64 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 106.57 -1.641 . . . . 0.0 106.57 178.951 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 29.5 m -128.35 139.69 52.25 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 104.346 -2.464 . . . . 0.0 104.346 179.156 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 77.8 mt -120.16 169.08 10.57 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-N 118.626 0.648 . . . . 0.0 109.764 179.605 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 12.3 mmt-85 -137.81 136.09 36.89 Favored 'General case' 0 C--O 1.237 0.397 0 C-N-CA 126.281 1.832 . . . . 0.0 109.38 -179.975 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . 0.44 ' H ' HG11 ' B' ' 16' ' ' VAL . 24.6 m-85 -133.95 152.58 51.91 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 106.715 -1.587 . . . . 0.0 106.715 178.76 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 4.9 m -69.04 166.93 23.43 Favored Pre-proline 0 CA--C 1.543 0.681 0 N-CA-C 107.734 -1.21 . . . . 0.0 107.734 178.929 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 19.5 Cg_endo -56.84 -48.62 17.66 Favored 'Trans proline' 0 N--CA 1.461 -0.425 0 C-N-CA 121.801 1.667 . . . . 0.0 112.21 -178.975 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 98.0 t -59.94 -43.67 92.81 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.471 0 C-N-CA 126.171 1.788 . . . . 0.0 110.722 179.861 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 88.0 mt-10 -67.39 -46.05 74.43 Favored 'General case' 0 C--N 1.334 -0.076 0 C-N-CA 124.991 1.316 . . . . 0.0 110.7 -178.827 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 30.5 t70 -62.4 -42.11 99.18 Favored 'General case' 0 CA--C 1.519 -0.213 0 N-CA-C 109.12 -0.696 . . . . 0.0 109.12 179.443 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 16.5 tt0 -66.28 -37.03 84.5 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 124.298 1.039 . . . . 0.0 109.79 178.883 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 95.3 m -64.35 -55.05 23.8 Favored 'General case' 0 CA--C 1.531 0.224 0 N-CA-C 106.949 -1.5 . . . . 0.0 106.949 178.68 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 75.1 mt -56.46 -45.68 81.95 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.247 0 C-N-CA 124.219 1.008 . . . . 0.0 108.987 -179.882 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 74.6 ttt180 -59.95 -47.54 85.38 Favored 'General case' 0 N--CA 1.457 -0.091 0 C-N-CA 123.511 0.724 . . . . 0.0 110.966 -179.785 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 11.7 mptt -64.02 -48.73 75.16 Favored 'General case' 0 CA--C 1.522 -0.109 0 CA-C-O 118.15 -0.928 . . . . 0.0 110.647 -179.792 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 24.9 mmtp -60.6 -46.12 91.42 Favored 'General case' 0 N--CA 1.463 0.213 0 CA-C-N 119.019 0.827 . . . . 0.0 109.915 -179.539 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -56.93 -55.28 36.63 Favored 'General case' 0 N--CA 1.454 -0.23 0 C-N-CA 124.013 0.925 . . . . 0.0 110.286 179.787 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 27.5 tt0 -64.43 -35.07 79.72 Favored 'General case' 0 N--CA 1.455 -0.21 0 CA-C-O 119.072 -0.49 . . . . 0.0 112.193 -178.761 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 41.8 t0 -66.21 -39.74 89.85 Favored 'General case' 0 N--CA 1.466 0.325 0 N-CA-C 107.838 -1.171 . . . . 0.0 107.838 179.484 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 22.9 t -75.57 -10.63 59.61 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 125.482 1.513 . . . . 0.0 110.211 178.374 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 73.06 4.15 62.3 Favored Glycine 0 CA--C 1.531 1.068 0 C-N-CA 125.551 1.548 . . . . 0.0 113.962 -179.984 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 12.9 mt -106.34 128.03 53.7 Favored 'General case' 0 CA--C 1.51 -0.584 0 N-CA-C 105.414 -2.069 . . . . 0.0 105.414 179.749 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 8.7 t -50.82 152.43 2.1 Favored 'General case' 0 CA--C 1.539 0.546 0 CA-C-O 121.435 0.636 . . . . 0.0 110.571 179.256 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 52.0 t -46.63 -40.49 4.55 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.166 0 C-N-CA 126.089 1.756 . . . . 0.0 111.908 -179.78 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 3.5 p -61.46 -42.58 99.0 Favored 'General case' 0 CA--C 1.535 0.365 0 CA-C-N 119.567 1.076 . . . . 0.0 111.37 -179.732 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -70.65 -42.13 71.23 Favored 'General case' 0 C--O 1.222 -0.391 0 N-CA-C 108.527 -0.916 . . . . 0.0 108.527 178.343 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 56.0 t80 -55.08 -51.5 66.19 Favored 'General case' 0 CA--C 1.535 0.396 0 CA-C-N 118.838 0.745 . . . . 0.0 109.083 179.235 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 18.1 mm -56.83 -61.44 1.23 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.19 0 C-N-CA 125.173 1.389 . . . . 0.0 110.207 179.686 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 11.8 ptt180 -51.58 -44.3 62.73 Favored 'General case' 0 C--O 1.222 -0.377 0 C-N-CA 123.655 0.782 . . . . 0.0 110.738 -179.135 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 2.2 t30 -62.07 -56.85 14.81 Favored 'General case' 0 N--CA 1.452 -0.338 0 C-N-CA 123.882 0.873 . . . . 0.0 110.031 179.016 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -59.12 -32.05 69.49 Favored 'General case' 0 C--O 1.224 -0.256 0 N-CA-C 113.521 0.934 . . . . 0.0 113.521 -178.645 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -76.28 -24.5 54.45 Favored 'General case' 0 CA--C 1.533 0.322 0 N-CA-C 113.696 0.999 . . . . 0.0 113.696 -179.485 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 17.9 mt -97.46 -28.3 14.05 Favored 'General case' 0 N--CA 1.466 0.339 0 C-N-CA 123.18 0.592 . . . . 0.0 110.288 179.62 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 43.1 m-80 . . . . . 0 C--O 1.253 1.276 0 C-N-CA 125.521 1.528 . . . . 0.0 108.335 179.133 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 5.5 t . . . . . 0 N--CA 1.443 -0.8 0 CA-C-O 123.986 1.85 . . . . 0.0 110.711 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' B' B ' 16' ' ' VAL . . . . . 0.44 HG11 ' H ' ' A' ' 22' ' ' PHE . 0.3 OUTLIER -130.24 148.46 33.16 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.794 0 N-CA-C 102.209 -3.256 . . . . 0.0 102.209 178.316 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 9.3 p -147.08 98.79 0.41 Allowed 'Isoleucine or valine' 0 N--CA 1.436 -1.173 0 N-CA-C 104.559 -2.386 . . . . 0.0 104.559 179.201 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 16.8 ttt85 -138.74 152.37 47.91 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.105 -0.952 . . . . 0.0 110.945 -179.265 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 19.6 m -91.73 135.89 33.56 Favored 'General case' 0 C--N 1.326 -0.435 0 C-N-CA 125.316 1.446 . . . . 0.0 108.195 179.92 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -139.09 134.82 33.43 Favored 'General case' 0 C--O 1.237 0.407 0 N-CA-C 108.84 -0.8 . . . . 0.0 108.84 179.085 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 50.1 mtm-85 -115.67 159.1 21.79 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 124.475 1.11 . . . . 0.0 110.798 179.363 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 22' ' ' PHE . . . . . . . . . . . . . 31.9 m-85 -145.43 154.24 42.04 Favored 'General case' 0 C--O 1.238 0.45 0 C-N-CA 125.398 1.479 . . . . 0.0 108.18 179.98 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 15.4 m -67.85 168.01 14.55 Favored Pre-proline 0 CA--C 1.537 0.46 0 N-CA-C 108.568 -0.901 . . . . 0.0 108.568 178.82 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 24' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -63.09 -42.19 24.6 Favored 'Trans proline' 0 N--CA 1.457 -0.63 0 CA-C-N 120.291 1.14 . . . . 0.0 109.329 179.356 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 25' ' ' VAL . . . . . . . . . . . . . 75.6 t -57.07 -44.75 83.53 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.585 0 C-N-CA 123.797 0.839 . . . . 0.0 109.637 178.925 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 49.3 mt-10 -66.23 -52.19 50.23 Favored 'General case' 0 N--CA 1.454 -0.23 0 C-N-CA 124.355 1.062 . . . . 0.0 110.392 -179.785 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 27' ' ' ASP . . . . . . . . . . . . . 34.9 t70 -60.27 -39.81 88.16 Favored 'General case' 0 C--O 1.223 -0.295 0 C-N-CA 123.692 0.797 . . . . 0.0 111.471 -179.237 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 28' ' ' GLU . . . . . . . . . . . . . 79.6 mt-10 -63.92 -50.91 66.85 Favored 'General case' 0 N--CA 1.453 -0.311 0 N-CA-C 107.616 -1.253 . . . . 0.0 107.616 178.506 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 90.2 m -55.1 -58.96 5.53 Favored 'General case' 0 CA--C 1.531 0.219 0 N-CA-C 109.104 -0.702 . . . . 0.0 109.104 179.618 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 92.9 mt -55.06 -47.03 77.53 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.353 0 C-N-CA 124.29 1.036 . . . . 0.0 110.132 -179.286 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 61.7 ttt180 -58.9 -48.83 80.05 Favored 'General case' 0 CA--C 1.52 -0.207 0 CA-C-N 119.093 0.861 . . . . 0.0 110.542 -179.752 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 10.6 mptt -61.7 -49.18 77.49 Favored 'General case' 0 C--O 1.22 -0.466 0 CA-C-O 118.546 -0.74 . . . . 0.0 109.889 -179.248 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 22.8 mmtp -56.71 -49.79 74.1 Favored 'General case' 0 CA--C 1.517 -0.319 0 C-N-CA 124.32 1.048 . . . . 0.0 109.574 -178.664 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 34' ' ' ALA . . . . . . . . . . . . . . . -56.19 -58.58 7.36 Favored 'General case' 0 N--CA 1.446 -0.646 0 C-N-CA 125.858 1.663 . . . . 0.0 110.5 179.967 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 11.6 tt0 -67.38 -20.21 65.52 Favored 'General case' 0 N--CA 1.467 0.391 0 N-CA-C 113.599 0.963 . . . . 0.0 113.599 -177.796 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 36' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -92.15 2.96 56.27 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 126.401 1.88 . . . . 0.0 110.7 178.884 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 37' ' ' SER . . . . . . . . . . . . . 18.6 t -122.59 -6.35 8.65 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 125.779 1.632 . . . . 0.0 111.021 -179.921 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 73.87 31.5 60.07 Favored Glycine 0 CA--C 1.527 0.783 0 N-CA-C 110.176 -1.169 . . . . 0.0 110.176 -179.455 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 39' ' ' LEU . . . . . . . . . . . . . 59.6 mt -128.19 129.56 46.66 Favored 'General case' 0 N--CA 1.446 -0.637 0 C-N-CA 125.959 1.704 . . . . 0.0 108.83 -178.491 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 40' ' ' THR . . . . . . . . . . . . . 1.8 t -66.59 152.4 45.37 Favored 'General case' 0 CA--C 1.541 0.611 0 N-CA-C 104.344 -2.465 . . . . 0.0 104.344 176.626 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 41' ' ' VAL . . . . . . . . . . . . . 55.0 t -47.58 -40.94 7.6 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.338 0 C-N-CA 124.596 1.158 . . . . 0.0 111.118 179.157 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 42' ' ' SER . . . . . . . . . . . . . 5.1 p -61.77 -44.21 97.33 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-N 120.007 1.276 . . . . 0.0 111.08 179.598 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -65.76 -40.53 92.13 Favored 'General case' 0 C--O 1.226 -0.18 0 C-N-CA 124.008 0.923 . . . . 0.0 109.059 178.776 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 44' ' ' TYR . . . . . . . . . . . . . 53.4 t80 -60.64 -52.64 64.28 Favored 'General case' 0 CA--C 1.534 0.35 0 N-CA-C 108.114 -1.069 . . . . 0.0 108.114 178.904 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 45' ' ' ILE . . . . . . . . . . . . . 23.2 mm -54.53 -62.19 0.8 Allowed 'Isoleucine or valine' 0 C--N 1.34 0.169 0 C-N-CA 124.537 1.135 . . . . 0.0 110.672 -179.888 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 46' ' ' ARG . . . . . . . . . . . . . 22.2 ptt180 -54.75 -47.03 74.34 Favored 'General case' 0 C--O 1.223 -0.291 0 CA-C-O 119.302 -0.38 . . . . 0.0 111.711 -178.856 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 47' ' ' ASN . . . . . . . . . . . . . 23.7 t30 -61.08 -52.04 66.62 Favored 'General case' 0 N--CA 1.448 -0.528 0 CA-C-O 118.282 -0.866 . . . . 0.0 111.132 -178.814 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -63.42 -27.86 69.58 Favored 'General case' 0 C--O 1.225 -0.223 0 C-N-CA 124.038 0.935 . . . . 0.0 112.075 179.776 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 49' ' ' ALA . . . . . . . . . . . . . . . -77.75 -34.8 52.29 Favored 'General case' 0 N--CA 1.457 -0.082 0 O-C-N 121.391 -0.818 . . . . 0.0 111.692 -179.914 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 38.1 mt -82.51 -46.16 13.77 Favored 'General case' 0 C--N 1.33 -0.249 0 C-N-CA 122.874 0.469 . . . . 0.0 110.629 -179.06 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 51' ' ' ASN . . . . . . . . . . . . . 42.5 m-80 . . . . . 0 C--O 1.248 0.981 0 C-N-CA 124.768 1.227 . . . . 0.0 110.668 -179.721 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 4.2 t . . . . . 0 N--CA 1.44 -0.941 0 CA-C-O 122.249 1.023 . . . . 0.0 108.793 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 95.2 t -97.86 145.34 9.66 Favored 'Isoleucine or valine' 0 CA--C 1.505 -0.755 0 C-N-CA 126.747 2.019 . . . . 0.0 105.918 179.308 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 7.8 p -145.62 99.95 0.51 Allowed 'Isoleucine or valine' 0 N--CA 1.441 -0.908 0 CA-C-O 122.6 1.191 . . . . 0.0 108.484 178.066 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 26.4 mtt-85 -143.12 157.39 44.56 Favored 'General case' 0 CA--C 1.511 -0.531 0 CA-C-N 115.084 -0.962 . . . . 0.0 110.234 178.824 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 96.6 m -86.42 100.5 12.39 Favored 'General case' 0 N--CA 1.446 -0.671 0 N-CA-C 106.664 -1.606 . . . . 0.0 106.664 179.548 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -95.4 86.68 4.57 Favored 'General case' 0 C--N 1.323 -0.579 0 C-N-CA 126.806 2.042 . . . . 0.0 107.321 -179.27 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 14.0 mtp180 -77.36 162.51 27.21 Favored 'General case' 0 N--CA 1.453 -0.316 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.64 179.246 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 92.7 m-85 -139.8 171.08 14.73 Favored 'General case' 0 CA--C 1.516 -0.349 0 C-N-CA 125.966 1.707 . . . . 0.0 108.068 178.985 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 7.7 m -106.2 172.56 3.83 Favored Pre-proline 0 CA--C 1.547 0.848 0 N-CA-C 108.063 -1.088 . . . . 0.0 108.063 179.306 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 92.5 Cg_endo -70.67 -33.99 12.27 Favored 'Trans proline' 0 N--CA 1.46 -0.482 0 CA-C-N 122.163 1.808 . . . . 0.0 113.341 -177.545 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 35.7 t -77.31 -36.3 23.77 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.31 0 N-CA-C 107.209 -1.404 . . . . 0.0 107.209 179.187 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 73.9 mt-10 -61.28 -54.1 48.35 Favored 'General case' 0 C--N 1.343 0.285 0 N-CA-C 107.523 -1.288 . . . . 0.0 107.523 178.709 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -57.34 -46.53 83.2 Favored 'General case' 0 C--O 1.217 -0.623 0 C-N-CA 125.068 1.347 . . . . 0.0 111.181 -179.838 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 13.3 tt0 -58.37 -51.38 70.07 Favored 'General case' 0 N--CA 1.452 -0.33 0 CA-C-O 118.726 -0.654 . . . . 0.0 111.204 179.745 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 85.5 m -57.33 -52.5 65.12 Favored 'General case' 0 CA--C 1.536 0.423 0 CA-C-N 118.766 0.712 . . . . 0.0 109.52 179.454 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 96.0 mt -56.89 -47.53 82.94 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.178 0 C-N-CA 123.392 0.677 . . . . 0.0 110.356 -179.299 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 33.1 ttt85 -61.78 -44.83 96.12 Favored 'General case' 0 N--CA 1.448 -0.545 0 C-N-CA 123.875 0.87 . . . . 0.0 111.769 -179.082 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 14.0 mptt -59.17 -51.22 70.95 Favored 'General case' 0 CA--C 1.516 -0.33 0 CA-C-N 118.549 0.613 . . . . 0.0 109.649 179.469 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 4.6 mptp? -62.9 -47.18 84.4 Favored 'General case' 0 CA--C 1.515 -0.379 0 CA-C-O 118.135 -0.936 . . . . 0.0 110.637 -179.01 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -56.15 -55.48 32.6 Favored 'General case' 0 N--CA 1.451 -0.391 0 C-N-CA 124.217 1.007 . . . . 0.0 109.776 179.505 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 5.3 tt0 -60.25 -38.65 84.13 Favored 'General case' 0 C--O 1.234 0.241 0 O-C-N 123.54 0.525 . . . . 0.0 111.545 -178.113 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -72.08 -24.93 61.58 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 123.872 0.869 . . . . 0.0 111.196 179.458 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 2.2 t -83.52 -8.15 59.4 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 126.477 1.911 . . . . 0.0 109.023 178.129 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 77.88 8.66 87.27 Favored Glycine 0 CA--C 1.529 0.957 0 CA-C-O 118.812 -0.994 . . . . 0.0 111.716 -179.029 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 40.1 mt -116.55 154.98 29.47 Favored 'General case' 0 N--CA 1.452 -0.344 0 CA-C-N 119.758 1.779 . . . . 0.0 111.457 -178.435 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -74.99 151.61 38.78 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 104.116 -2.549 . . . . 0.0 104.116 176.159 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 19.4 m -51.2 -31.29 11.06 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.929 0 CA-C-N 114.873 -1.058 . . . . 0.0 110.937 178.93 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 29.3 t -61.0 -58.94 6.32 Favored 'General case' 0 CA--C 1.536 0.435 0 CA-C-N 119.421 1.009 . . . . 0.0 108.936 178.549 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -58.98 -39.52 82.02 Favored 'General case' 0 C--O 1.223 -0.3 0 C-N-CA 123.662 0.785 . . . . 0.0 109.385 178.78 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 77.8 t80 -60.78 -50.19 74.45 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-O 119.084 -0.484 . . . . 0.0 109.737 179.059 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 10.8 mm -55.6 -62.96 0.66 Allowed 'Isoleucine or valine' 0 N--CA 1.463 0.182 0 C-N-CA 125.272 1.429 . . . . 0.0 109.904 179.99 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 27.3 ptt180 -53.08 -44.09 67.28 Favored 'General case' 0 N--CA 1.454 -0.271 0 C-N-CA 123.293 0.637 . . . . 0.0 110.708 -178.579 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 39.1 t30 -63.2 -55.98 20.5 Favored 'General case' 0 N--CA 1.45 -0.444 0 C-N-CA 123.502 0.721 . . . . 0.0 111.583 -179.798 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -61.35 -28.35 69.16 Favored 'General case' 0 N--CA 1.463 0.223 0 C-N-CA 123.965 0.906 . . . . 0.0 112.096 -178.91 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -74.93 -27.62 60.28 Favored 'General case' 0 N--CA 1.453 -0.281 0 N-CA-C 113.022 0.749 . . . . 0.0 113.022 -179.468 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 13.7 mt -93.83 -44.64 8.02 Favored 'General case' 0 C--N 1.332 -0.193 0 C-N-CA 122.849 0.46 . . . . 0.0 110.747 -179.378 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 79.1 m-20 . . . . . 0 C--O 1.244 0.789 0 C-N-CA 124.622 1.169 . . . . 0.0 111.249 -178.229 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 3.4 t . . . . . 0 N--CA 1.451 -0.378 0 N-CA-C 108.567 -0.901 . . . . 0.0 108.567 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 12.1 t -128.46 115.82 39.29 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.663 0 N-CA-C 103.944 -2.613 . . . . 0.0 103.944 178.954 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 9.0 p -116.74 107.14 21.69 Favored 'Isoleucine or valine' 0 C--O 1.237 0.396 0 CA-C-O 121.957 0.884 . . . . 0.0 110.819 -178.898 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 36.4 mtt180 -133.64 -175.7 3.91 Favored 'General case' 0 C--O 1.239 0.525 0 N-CA-C 108.622 -0.881 . . . . 0.0 108.622 178.189 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 1.9 m -122.34 105.91 10.61 Favored 'General case' 0 N--CA 1.448 -0.555 0 N-CA-C 102.155 -3.276 . . . . 0.0 102.155 178.621 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 15.5 tp -112.27 89.74 3.15 Favored 'General case' 0 N--CA 1.442 -0.836 0 C-N-CA 125.241 1.416 . . . . 0.0 110.454 -177.975 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -63.38 157.42 23.18 Favored 'General case' 0 N--CA 1.452 -0.347 0 C-N-CA 124.614 1.166 . . . . 0.0 110.125 178.177 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 22' ' ' PHE . . . . . . . . . . . . . 88.2 m-85 -138.65 143.63 39.32 Favored 'General case' 0 C--O 1.236 0.389 0 N-CA-C 103.915 -2.624 . . . . 0.0 103.915 177.198 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 3.3 m -73.88 169.41 18.94 Favored Pre-proline 0 C--N 1.32 -0.692 0 C-N-CA 124.204 1.002 . . . . 0.0 109.535 -179.144 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 24' ' ' PRO . . . . . . . . . . . . . 33.9 Cg_endo -63.25 -43.61 17.93 Favored 'Trans proline' 0 N--CA 1.46 -0.493 0 C-N-CA 121.401 1.401 . . . . 0.0 111.277 -179.371 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 25' ' ' VAL . . . . . . . . . . . . . 24.6 t -66.68 -39.91 84.88 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.298 0 C-N-CA 124.575 1.15 . . . . 0.0 110.313 -179.92 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 83.7 mt-10 -67.13 -44.25 80.34 Favored 'General case' 0 C--N 1.339 0.115 0 N-CA-C 109.359 -0.608 . . . . 0.0 109.359 -179.854 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 27' ' ' ASP . . . . . . . . . . . . . 28.9 t70 -61.3 -44.86 96.51 Favored 'General case' 0 C--O 1.214 -0.783 0 C-N-CA 123.739 0.815 . . . . 0.0 109.131 179.305 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 28' ' ' GLU . . . . . . . . . . . . . 72.7 tt0 -57.64 -52.91 63.51 Favored 'General case' 0 N--CA 1.445 -0.698 0 C-N-CA 125.019 1.328 . . . . 0.0 108.892 178.398 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 96.2 m -60.49 -53.39 58.1 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-N 120.343 1.429 . . . . 0.0 110.36 179.316 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 50.4 mt -55.3 -49.98 68.43 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.272 0 C-N-CA 123.099 0.559 . . . . 0.0 109.761 -179.513 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 31.8 ttt85 -62.09 -43.4 98.92 Favored 'General case' 0 CA--C 1.51 -0.593 0 CA-C-O 117.425 -1.274 . . . . 0.0 110.908 -179.17 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 9.7 mptt -61.11 -48.81 79.95 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 119.85 1.205 . . . . 0.0 109.164 -179.828 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -63.61 -49.34 73.69 Favored 'General case' 0 N--CA 1.455 -0.186 0 CA-C-N 117.988 0.358 . . . . 0.0 110.183 -179.133 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 34' ' ' ALA . . . . . . . . . . . . . . . -56.3 -57.04 13.96 Favored 'General case' 0 N--CA 1.452 -0.326 0 C-N-CA 126.41 1.884 . . . . 0.0 111.069 179.866 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 59.8 tt0 -60.94 -42.65 98.61 Favored 'General case' 0 C--O 1.233 0.202 0 C-N-CA 125.181 1.392 . . . . 0.0 111.286 -178.454 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 36' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -65.52 -40.86 93.44 Favored 'General case' 0 C--N 1.333 -0.134 0 C-N-CA 123.604 0.762 . . . . 0.0 108.957 179.622 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 37' ' ' SER . . . . . . . . . . . . . 9.9 t -77.77 -4.77 48.1 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 124.151 0.981 . . . . 0.0 110.128 178.553 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 63.53 25.9 69.17 Favored Glycine 0 CA--C 1.529 0.948 0 C-N-CA 124.662 1.125 . . . . 0.0 112.912 -179.842 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 39' ' ' LEU . . . . . . . . . . . . . 40.2 mt -119.19 120.94 38.56 Favored 'General case' 0 CA--C 1.507 -0.692 0 N-CA-C 105.439 -2.06 . . . . 0.0 105.439 179.729 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 40' ' ' THR . . . . . . . . . . . . . 12.8 t -53.54 148.87 8.71 Favored 'General case' 0 C--O 1.237 0.407 0 N-CA-C 108.43 -0.952 . . . . 0.0 108.43 178.44 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 41' ' ' VAL . . . . . . . . . . . . . 22.0 m -48.23 -34.3 4.8 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.721 0 CA-C-N 114.79 -1.096 . . . . 0.0 112.142 -179.149 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 42' ' ' SER . . . . . . . . . . . . . 22.9 t -61.27 -49.96 74.96 Favored 'General case' 0 CA--C 1.544 0.744 0 CA-C-N 119.611 1.096 . . . . 0.0 110.143 178.868 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -67.51 -43.42 80.92 Favored 'General case' 0 C--O 1.225 -0.212 0 C-N-CA 123.592 0.757 . . . . 0.0 109.078 178.722 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 44' ' ' TYR . . . . . . . . . . . . . 74.5 t80 -54.58 -50.47 67.92 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 123.163 0.585 . . . . 0.0 109.722 179.529 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 45' ' ' ILE . . . . . . . . . . . . . 12.4 mm -57.28 -64.23 0.55 Allowed 'Isoleucine or valine' 0 C--N 1.341 0.208 0 C-N-CA 125.762 1.625 . . . . 0.0 110.336 179.834 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 46' ' ' ARG . . . . . . . . . . . . . 21.9 ptt180 -53.12 -46.83 68.92 Favored 'General case' 0 C--O 1.222 -0.361 0 CA-C-O 119.148 -0.453 . . . . 0.0 111.06 -178.267 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 47' ' ' ASN . . . . . . . . . . . . . 34.5 t30 -57.76 -51.57 69.04 Favored 'General case' 0 N--CA 1.453 -0.279 0 CA-C-O 118.819 -0.61 . . . . 0.0 111.288 -179.527 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -61.2 -32.77 72.53 Favored 'General case' 0 CA--C 1.53 0.206 0 C-N-CA 123.326 0.651 . . . . 0.0 111.366 -179.899 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 49' ' ' ALA . . . . . . . . . . . . . . . -77.53 -17.72 57.66 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 124.416 1.086 . . . . 0.0 113.729 -179.438 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 22.0 mt -102.84 -37.24 7.94 Favored 'General case' 0 CA--C 1.517 -0.306 0 CA-C-N 118.857 0.753 . . . . 0.0 110.987 -179.546 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 51' ' ' ASN . . . . . . . . . . . . . 7.4 m-80 . . . . . 0 C--O 1.248 1.02 0 C-N-CA 125.302 1.441 . . . . 0.0 107.953 179.704 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' THR . . . . . 0.507 ' CG2' HH11 ' B' ' 21' ' ' ARG . 7.2 t . . . . . 0 N--CA 1.45 -0.446 0 CA-C-O 122.179 0.99 . . . . 0.0 108.861 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 18.0 t -91.85 149.15 4.22 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.724 0 N-CA-C 106.069 -1.826 . . . . 0.0 106.069 178.297 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 10.4 p -139.82 90.62 0.6 Allowed 'Isoleucine or valine' 0 N--CA 1.442 -0.863 0 N-CA-C 104.701 -2.333 . . . . 0.0 104.701 177.321 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 50.6 ttt180 -116.02 170.74 8.26 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 114.519 -1.219 . . . . 0.0 108.645 -179.288 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 10.8 m -117.09 128.34 55.05 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 106.846 -1.539 . . . . 0.0 106.846 179.779 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -125.9 150.47 47.91 Favored 'General case' 0 C--O 1.235 0.31 0 C-N-CA 124.949 1.3 . . . . 0.0 109.235 -179.362 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 68.5 mtt180 -137.8 158.7 43.82 Favored 'General case' 0 N--CA 1.447 -0.587 0 C-N-CA 125.411 1.485 . . . . 0.0 108.232 178.439 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 50.0 m-85 -145.12 156.57 43.96 Favored 'General case' 0 C--O 1.237 0.415 0 N-CA-C 107.84 -1.17 . . . . 0.0 107.84 179.687 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -68.91 168.9 12.92 Favored Pre-proline 0 CA--C 1.543 0.704 0 N-CA-C 107.421 -1.326 . . . . 0.0 107.421 178.7 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 25.3 Cg_endo -61.93 -45.06 17.69 Favored 'Trans proline' 0 N--CA 1.456 -0.702 0 CA-C-N 120.701 1.286 . . . . 0.0 111.264 -178.761 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 72.1 t -65.82 -42.6 92.57 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.29 0 C-N-CA 123.077 0.551 . . . . 0.0 109.908 179.536 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 7.2 mm-40 -60.35 -45.38 93.68 Favored 'General case' 0 CA--C 1.531 0.223 0 C-N-CA 123.307 0.643 . . . . 0.0 109.358 -179.893 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 26.9 t70 -66.59 -44.03 83.29 Favored 'General case' 0 C--O 1.221 -0.416 0 CA-C-O 118.984 -0.532 . . . . 0.0 110.223 179.562 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 31.7 tt0 -58.08 -43.55 87.07 Favored 'General case' 0 CA--C 1.531 0.213 0 C-N-CA 124.758 1.223 . . . . 0.0 109.055 178.976 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 37.4 m -61.22 -50.63 72.31 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 124.283 1.033 . . . . 0.0 108.634 179.273 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 64.7 mt -61.49 -41.34 89.68 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.327 0 N-CA-C 109.262 -0.644 . . . . 0.0 109.262 179.677 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 23.3 ttp85 -60.39 -46.39 90.14 Favored 'General case' 0 N--CA 1.461 0.099 0 C-N-CA 124.003 0.921 . . . . 0.0 109.575 -179.627 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 1.9 mptm? -59.98 -59.04 6.05 Favored 'General case' 0 N--CA 1.45 -0.453 0 C-N-CA 124.993 1.317 . . . . 0.0 110.956 179.537 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 17.5 tptt -60.84 -40.86 94.43 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-O 118.576 -0.726 . . . . 0.0 111.588 -177.479 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -58.45 -51.65 68.94 Favored 'General case' 0 N--CA 1.452 -0.348 0 N-CA-C 108.596 -0.89 . . . . 0.0 108.596 178.813 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 21.8 tt0 -62.17 -41.99 98.84 Favored 'General case' 0 CA--C 1.529 0.157 0 C-N-CA 123.238 0.615 . . . . 0.0 112.093 -179.565 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 38.7 t70 -66.56 -22.88 66.15 Favored 'General case' 0 C--O 1.232 0.167 0 C-N-CA 126.562 1.945 . . . . 0.0 111.281 -179.856 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 10.4 t -97.15 -8.28 30.47 Favored 'General case' 0 N--CA 1.449 -0.523 0 C-N-CA 127.076 2.151 . . . . 0.0 110.994 179.688 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 64.11 31.66 81.59 Favored Glycine 0 CA--C 1.532 1.134 0 O-C-N 120.723 -1.236 . . . . 0.0 111.418 -179.327 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 55.7 mt -127.8 132.54 49.47 Favored 'General case' 0 N--CA 1.448 -0.536 0 N-CA-C 105.2 -2.148 . . . . 0.0 105.2 -179.981 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 8.4 t -61.75 152.76 30.35 Favored 'General case' 0 CA--C 1.538 0.5 0 N-CA-C 107.692 -1.225 . . . . 0.0 107.692 178.679 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 24.1 t -48.33 -41.32 10.8 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.289 0 C-N-CA 124.549 1.14 . . . . 0.0 111.755 -179.974 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 13.5 p -63.65 -38.25 90.39 Favored 'General case' 0 CA--C 1.532 0.255 0 O-C-N 121.024 -1.048 . . . . 0.0 112.08 179.841 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -69.66 -46.86 65.17 Favored 'General case' 0 C--O 1.222 -0.354 0 N-CA-C 107.607 -1.257 . . . . 0.0 107.607 178.334 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 69.6 t80 -52.87 -46.31 67.85 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 123.973 0.909 . . . . 0.0 110.112 179.152 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 14.8 mm -56.98 -63.57 0.63 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.315 0 C-N-CA 124.044 0.938 . . . . 0.0 110.526 179.429 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 12.4 ptt180 -55.47 -45.16 76.94 Favored 'General case' 0 C--O 1.222 -0.365 0 C-N-CA 123.497 0.719 . . . . 0.0 110.989 -178.55 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 32.2 t30 -58.69 -55.79 30.6 Favored 'General case' 0 N--CA 1.449 -0.521 0 C-N-CA 124.601 1.16 . . . . 0.0 109.065 -179.189 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -61.77 -25.9 67.75 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 123.065 0.546 . . . . 0.0 112.442 179.637 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -79.07 -19.38 51.44 Favored 'General case' 0 CA--C 1.536 0.44 0 N-CA-C 113.341 0.867 . . . . 0.0 113.341 179.523 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 7.9 mt -115.3 -29.03 6.7 Favored 'General case' 0 N--CA 1.466 0.328 0 N-CA-C 114.133 1.16 . . . . 0.0 114.133 -177.966 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 2.0 m-80 . . . . . 0 C--O 1.249 1.048 0 C-N-CA 125.512 1.525 . . . . 0.0 110.3 -178.183 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 7.9 t . . . . . 0 N--CA 1.449 -0.483 0 N-CA-C 106.201 -1.777 . . . . 0.0 106.201 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 9.3 p -109.98 155.99 11.03 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.813 0 N-CA-C 104.619 -2.363 . . . . 0.0 104.619 177.391 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 14.2 p -138.79 122.18 19.3 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.734 0 N-CA-C 106.305 -1.739 . . . . 0.0 106.305 177.964 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 23.8 ttt180 -140.65 159.09 42.97 Favored 'General case' 0 CA--C 1.516 -0.334 0 CA-C-O 122.826 1.298 . . . . 0.0 111.44 179.565 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 1.3 m -108.06 102.47 11.63 Favored 'General case' 0 N--CA 1.445 -0.71 0 N-CA-C 101.294 -3.595 . . . . 0.0 101.294 179.693 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -108.52 120.28 41.98 Favored 'General case' 0 CA--C 1.515 -0.372 0 C-N-CA 124.437 1.095 . . . . 0.0 108.375 -178.504 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 21' ' ' ARG . . . . . 0.507 HH11 ' CG2' ' A' ' 15' ' ' THR . 24.2 mtt180 -95.71 153.65 17.62 Favored 'General case' 0 N--CA 1.449 -0.493 0 N-CA-C 109.109 -0.7 . . . . 0.0 109.109 179.188 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 22' ' ' PHE . . . . . . . . . . . . . 92.9 m-85 -134.88 144.27 47.44 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 106.728 -1.582 . . . . 0.0 106.728 -179.814 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -74.78 171.16 12.28 Favored Pre-proline 0 CA--C 1.544 0.741 0 N-CA-C 108.075 -1.083 . . . . 0.0 108.075 179.948 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 24' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -66.94 -31.32 38.12 Favored 'Trans proline' 0 N--CA 1.459 -0.547 0 C-N-CA 121.472 1.448 . . . . 0.0 113.562 -178.332 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 25' ' ' VAL . . . . . . . . . . . . . 89.8 t -75.37 -40.8 42.81 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.307 0 N-CA-C 109.031 -0.729 . . . . 0.0 109.031 -179.832 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -62.86 -48.18 80.13 Favored 'General case' 0 C--O 1.217 -0.631 0 N-CA-C 108.164 -1.051 . . . . 0.0 108.164 179.889 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 27' ' ' ASP . . . . . . . . . . . . . 20.9 t0 -56.03 -48.51 75.84 Favored 'General case' 0 CA--C 1.515 -0.385 0 C-N-CA 124.899 1.28 . . . . 0.0 111.169 -179.514 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 28' ' ' GLU . . . . . . . . . . . . . 36.1 tt0 -60.51 -47.15 87.42 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 124.58 1.152 . . . . 0.0 108.833 179.097 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 31.7 m -60.89 -55.15 36.37 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 124.167 0.987 . . . . 0.0 110.428 179.484 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 96.7 mt -62.21 -30.83 49.73 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.48 0 C-N-CA 126.132 1.773 . . . . 0.0 110.641 -178.654 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 9.6 ttt85 -67.58 -43.82 79.64 Favored 'General case' 0 C--N 1.327 -0.395 0 O-C-N 120.515 -1.366 . . . . 0.0 110.104 179.437 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 1.2 mptm? -78.47 -44.46 24.53 Favored 'General case' 0 C--O 1.225 -0.214 0 CA-C-O 117.552 -1.213 . . . . 0.0 113.918 -178.07 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 34.9 tptt -62.64 -39.68 94.61 Favored 'General case' 0 N--CA 1.462 0.166 0 CA-C-N 119.966 1.257 . . . . 0.0 110.615 -178.109 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 34' ' ' ALA . . . . . . . . . . . . . . . -58.73 -55.74 31.17 Favored 'General case' 0 N--CA 1.448 -0.539 0 C-N-CA 124.839 1.256 . . . . 0.0 109.019 179.072 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 16.8 tt0 -65.46 -34.89 79.35 Favored 'General case' 0 N--CA 1.453 -0.316 0 CA-C-N 115.37 -0.832 . . . . 0.0 113.027 -178.321 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 36' ' ' ASP . . . . . . . . . . . . . 18.3 t70 -64.86 -40.85 95.79 Favored 'General case' 0 C--O 1.235 0.334 0 N-CA-C 107.929 -1.137 . . . . 0.0 107.929 178.361 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 37' ' ' SER . . . . . . . . . . . . . 6.9 t -77.75 -7.17 56.17 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 124.887 1.275 . . . . 0.0 110.671 178.821 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 72.7 2.54 56.7 Favored Glycine 0 CA--C 1.534 1.265 0 C-N-CA 125.032 1.301 . . . . 0.0 112.257 -179.068 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 39' ' ' LEU . . . . . . . . . . . . . 11.2 mt -99.6 106.31 18.27 Favored 'General case' 0 N--CA 1.447 -0.6 0 C-N-CA 125.952 1.701 . . . . 0.0 107.294 -179.52 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 40' ' ' THR . . . . . . . . . . . . . 8.8 t -45.27 150.83 0.4 Allowed 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 124.947 1.299 . . . . 0.0 109.67 179.016 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 41' ' ' VAL . . . . . . . . . . . . . 65.4 t -43.46 -44.64 1.61 Allowed 'Isoleucine or valine' 0 N--CA 1.461 0.096 0 C-N-CA 125.85 1.66 . . . . 0.0 112.473 -177.705 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 42' ' ' SER . . . . . . . . . . . . . 1.4 p -61.41 -46.75 88.84 Favored 'General case' 0 CA--C 1.538 0.489 0 CA-C-N 119.518 1.053 . . . . 0.0 111.615 179.896 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -66.52 -39.03 88.41 Favored 'General case' 0 C--O 1.225 -0.2 0 C-N-CA 123.251 0.621 . . . . 0.0 109.566 178.557 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 44' ' ' TYR . . . . . . . . . . . . . 61.7 t80 -58.82 -52.85 63.96 Favored 'General case' 0 C--O 1.221 -0.413 0 N-CA-C 108.495 -0.928 . . . . 0.0 108.495 179.134 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 45' ' ' ILE . . . . . . . . . . . . . 21.2 mm -53.45 -61.63 0.84 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.196 0 C-N-CA 124.173 0.989 . . . . 0.0 109.577 179.819 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 46' ' ' ARG . . . . . . . . . . . . . 18.4 ptt180 -52.0 -47.51 64.88 Favored 'General case' 0 CA--C 1.53 0.194 0 N-CA-C 112.704 0.631 . . . . 0.0 112.704 -179.012 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 47' ' ' ASN . . . . . . . . . . . . . 32.6 t30 -66.05 -52.44 48.96 Favored 'General case' 0 C--N 1.329 -0.322 0 C-N-CA 125.37 1.468 . . . . 0.0 112.987 -179.352 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -61.84 -33.26 73.84 Favored 'General case' 0 C--O 1.223 -0.333 0 C-N-CA 125.293 1.437 . . . . 0.0 110.976 -179.594 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 49' ' ' ALA . . . . . . . . . . . . . . . -66.71 -55.57 14.51 Favored 'General case' 0 N--CA 1.444 -0.762 0 C-N-CA 122.41 0.284 . . . . 0.0 111.02 -179.77 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 14.8 mt -69.62 -40.19 76.74 Favored 'General case' 0 CA--C 1.516 -0.341 0 N-CA-C 115.562 1.69 . . . . 0.0 115.562 -177.327 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 51' ' ' ASN . . . . . . . . . . . . . 57.0 m-80 . . . . . 0 C--O 1.251 1.153 0 CA-C-O 118.321 -0.847 . . . . 0.0 111.165 -176.774 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 11.8 t . . . . . 0 N--CA 1.437 -1.1 0 N-CA-C 107.844 -1.169 . . . . 0.0 107.844 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 95.9 t -97.28 154.64 3.69 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.879 0 N-CA-C 104.457 -2.423 . . . . 0.0 104.457 177.835 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 8.3 p -144.09 101.85 0.7 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.532 0 N-CA-C 105.598 -2.001 . . . . 0.0 105.598 178.68 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 10.6 ttm180 -144.09 172.7 12.53 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 107.843 -1.169 . . . . 0.0 107.843 179.392 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -121.59 136.87 54.93 Favored 'General case' 0 C--N 1.321 -0.637 0 C-N-CA 127.217 2.207 . . . . 0.0 107.597 -179.567 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 74.0 mt -120.84 170.8 9.13 Favored 'General case' 0 C--O 1.236 0.39 0 N-CA-C 107.464 -1.309 . . . . 0.0 107.464 178.547 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 23.4 mmt-85 -128.77 151.16 49.88 Favored 'General case' 0 C--N 1.327 -0.412 0 C-N-CA 124.978 1.311 . . . . 0.0 107.967 179.639 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 98.5 m-85 -147.87 140.91 24.95 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 106.429 -1.693 . . . . 0.0 106.429 179.588 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 1.5 m -68.96 172.14 5.37 Favored Pre-proline 0 CA--C 1.545 0.755 0 C-N-CA 124.26 1.024 . . . . 0.0 108.664 179.381 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 59.4 Cg_endo -67.72 -38.28 14.21 Favored 'Trans proline' 0 N--CA 1.458 -0.609 0 CA-C-N 121.271 1.49 . . . . 0.0 111.351 -179.067 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 21.3 t -72.46 -36.38 54.34 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.488 0 C-N-CA 123.105 0.562 . . . . 0.0 109.796 179.632 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -67.85 -42.66 81.03 Favored 'General case' 0 C--O 1.225 -0.224 0 N-CA-C 108.724 -0.843 . . . . 0.0 108.724 179.377 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 26.5 t70 -65.4 -46.02 81.68 Favored 'General case' 0 C--O 1.224 -0.286 0 N-CA-C 108.915 -0.772 . . . . 0.0 108.915 178.763 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 63.9 tt0 -54.74 -48.57 72.4 Favored 'General case' 0 N--CA 1.452 -0.367 0 C-N-CA 125.112 1.365 . . . . 0.0 108.052 178.23 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 46.1 m -67.51 -51.31 52.6 Favored 'General case' 0 C--O 1.222 -0.388 0 C-N-CA 124.149 0.98 . . . . 0.0 111.3 -179.441 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 59.6 mt -60.25 -31.96 49.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 O-C-N 120.52 -1.363 . . . . 0.0 110.109 -179.436 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 31.9 ttt180 -76.24 -45.14 34.31 Favored 'General case' 0 CA--C 1.511 -0.545 0 N-CA-C 109.318 -0.623 . . . . 0.0 109.318 -179.151 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . 0.391 0.0 OUTLIER -66.04 -30.64 71.21 Favored 'General case' 0 N--CA 1.45 -0.447 0 O-C-N 123.277 0.361 . . . . 0.0 110.259 -179.856 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 7.4 mmmm -77.48 -48.91 15.92 Favored 'General case' 0 C--O 1.222 -0.362 0 N-CA-C 107.346 -1.353 . . . . 0.0 107.346 178.178 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -54.4 -57.14 12.45 Favored 'General case' 0 C--N 1.339 0.112 0 C-N-CA 124.083 0.953 . . . . 0.0 110.278 -179.803 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 7.5 tp10 -62.96 -41.26 99.47 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-O 118.881 -0.581 . . . . 0.0 111.845 -179.059 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 37.0 t70 -66.36 -26.84 67.46 Favored 'General case' 0 N--CA 1.47 0.571 0 CA-C-N 119.435 1.016 . . . . 0.0 110.724 179.771 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 1.7 t -89.81 -2.28 58.18 Favored 'General case' 0 N--CA 1.447 -0.625 0 C-N-CA 124.533 1.133 . . . . 0.0 110.119 178.861 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 65.23 33.97 88.29 Favored Glycine 0 CA--C 1.526 0.77 0 CA-C-O 118.835 -0.98 . . . . 0.0 112.569 179.627 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 81.0 mt -128.29 152.58 47.96 Favored 'General case' 0 C--O 1.233 0.23 0 C-N-CA 125.502 1.521 . . . . 0.0 108.589 179.924 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -76.71 148.48 36.75 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 104.24 -2.504 . . . . 0.0 104.24 177.183 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 20.1 t -50.35 -39.78 17.35 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.539 0 C-N-CA 124.683 1.193 . . . . 0.0 109.477 177.844 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 66.2 p -58.75 -48.14 82.24 Favored 'General case' 0 CA--C 1.539 0.555 0 O-C-N 121.105 -0.997 . . . . 0.0 111.777 179.47 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -67.6 -46.44 72.58 Favored 'General case' 0 C--O 1.221 -0.403 0 C-N-CA 125.09 1.356 . . . . 0.0 108.581 179.053 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 55.0 t80 -52.66 -53.66 44.09 Favored 'General case' 0 N--CA 1.451 -0.379 0 C-N-CA 124.703 1.201 . . . . 0.0 109.487 179.959 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 18.4 mm -51.94 -62.11 0.63 Allowed 'Isoleucine or valine' 0 C--N 1.341 0.218 0 C-N-CA 124.575 1.15 . . . . 0.0 111.258 -179.784 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 12.7 ptm180 -60.92 -46.28 91.31 Favored 'General case' 0 C--O 1.222 -0.374 0 CA-C-O 118.687 -0.673 . . . . 0.0 111.687 -178.682 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 10.7 t30 -51.96 -55.22 21.7 Favored 'General case' 0 C--N 1.332 -0.184 0 C-N-CA 124.405 1.082 . . . . 0.0 110.089 -179.443 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -66.18 -29.83 70.18 Favored 'General case' 0 N--CA 1.453 -0.298 0 C-N-CA 124.99 1.316 . . . . 0.0 113.149 179.924 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -81.38 -19.8 41.9 Favored 'General case' 0 N--CA 1.462 0.151 0 N-CA-C 113.362 0.875 . . . . 0.0 113.362 -179.303 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 23.4 mt -106.19 -36.98 6.73 Favored 'General case' 0 CA--C 1.516 -0.332 0 N-CA-C 114.015 1.117 . . . . 0.0 114.015 -178.533 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 12.7 m-80 . . . . . 0 C--O 1.248 1.015 0 CA-C-O 117.805 -1.093 . . . . 0.0 110.972 -176.975 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 14.3 t . . . . . 0 N--CA 1.44 -0.955 0 N-CA-C 106.634 -1.617 . . . . 0.0 106.634 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 5.4 t -109.8 156.97 10.47 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.574 0 N-CA-C 106.515 -1.661 . . . . 0.0 106.515 177.909 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 11.5 p -137.69 113.67 11.06 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.681 0 N-CA-C 105.182 -2.155 . . . . 0.0 105.182 176.939 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 34.5 ttm-85 -145.19 149.11 34.37 Favored 'General case' 0 CA--C 1.514 -0.422 0 CA-C-O 121.059 0.457 . . . . 0.0 109.8 178.936 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -93.85 132.77 37.93 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 107.402 -1.333 . . . . 0.0 107.402 -179.482 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 69.9 mt -129.49 151.96 49.54 Favored 'General case' 0 C--O 1.239 0.542 0 N-CA-C 107.532 -1.284 . . . . 0.0 107.532 178.747 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 22.0 mmt85 -112.6 151.19 30.37 Favored 'General case' 0 C--N 1.323 -0.571 0 C-N-CA 127.977 2.511 . . . . 0.0 108.234 -179.798 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 22' ' ' PHE . . . . . . . . . . . . . 89.7 m-85 -148.73 139.43 22.78 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 104.829 -2.285 . . . . 0.0 104.829 178.769 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 4.7 m -70.57 168.54 18.97 Favored Pre-proline 0 CA--C 1.551 1.012 0 N-CA-C 108.279 -1.008 . . . . 0.0 108.279 179.408 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 24' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -66.14 -40.88 14.33 Favored 'Trans proline' 0 N--CA 1.46 -0.456 0 C-N-CA 122.475 2.117 . . . . 0.0 114.178 -177.363 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 25' ' ' VAL . . . . . . . . . . . . . 77.1 t -66.81 -45.62 87.31 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.305 0 C-N-CA 123.94 0.896 . . . . 0.0 109.51 -179.709 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -68.08 -38.85 82.84 Favored 'General case' 0 N--CA 1.453 -0.297 0 C-N-CA 124.68 1.192 . . . . 0.0 110.983 -178.495 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 27' ' ' ASP . . . . . . . . . . . . . 10.1 t70 -64.59 -44.1 91.7 Favored 'General case' 0 N--CA 1.454 -0.264 0 C-N-CA 123.102 0.561 . . . . 0.0 109.998 178.473 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 28' ' ' GLU . . . . . . . . . . . . . 26.5 tt0 -62.16 -45.75 92.02 Favored 'General case' 0 N--CA 1.449 -0.514 0 N-CA-C 108.105 -1.072 . . . . 0.0 108.105 179.556 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 31.0 m -56.06 -52.91 62.56 Favored 'General case' 0 C--N 1.341 0.199 0 N-CA-C 108.512 -0.921 . . . . 0.0 108.512 178.699 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 84.4 mt -58.0 -41.17 79.66 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.3 0 C-N-CA 122.66 0.384 . . . . 0.0 110.099 -179.717 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 37.4 ttt-85 -61.42 -47.43 85.81 Favored 'General case' 0 C--O 1.23 0.067 0 O-C-N 121.45 -0.781 . . . . 0.0 110.62 -179.647 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 2.6 mptm? -65.48 -46.83 78.2 Favored 'General case' 0 CA--C 1.523 -0.083 0 C-N-CA 123.008 0.523 . . . . 0.0 110.473 -179.593 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 9.1 mmmm -59.46 -48.31 82.13 Favored 'General case' 0 CA--C 1.527 0.065 0 N-CA-C 109.272 -0.64 . . . . 0.0 109.272 -179.655 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 34' ' ' ALA . . . . . . . . . . . . . . . -59.43 -49.77 76.52 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 124.768 1.227 . . . . 0.0 112.156 -179.821 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 5.4 tp10 -56.0 -49.69 72.94 Favored 'General case' 0 C--O 1.233 0.186 0 C-N-CA 124.414 1.086 . . . . 0.0 110.696 -179.495 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 36' ' ' ASP . . . . . . . . . . . . . 6.8 t70 -67.89 -44.05 77.88 Favored 'General case' 0 N--CA 1.454 -0.262 0 C-N-CA 124.107 0.963 . . . . 0.0 111.875 -178.927 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 37' ' ' SER . . . . . . . . . . . . . 30.4 t -66.24 -18.77 65.56 Favored 'General case' 0 N--CA 1.448 -0.556 0 C-N-CA 124.403 1.081 . . . . 0.0 110.943 -179.453 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 73.47 20.35 79.84 Favored Glycine 0 CA--C 1.528 0.893 0 N-CA-C 110.632 -0.987 . . . . 0.0 110.632 -179.189 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 39' ' ' LEU . . . . . . . . . . . . . 81.4 mt -120.45 107.81 13.34 Favored 'General case' 0 N--CA 1.447 -0.576 0 N-CA-C 103.121 -2.918 . . . . 0.0 103.121 179.56 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 40' ' ' THR . . . . . . . . . . . . . 13.8 t -50.76 156.3 0.98 Allowed 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 123.342 0.657 . . . . 0.0 109.502 -179.776 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 41' ' ' VAL . . . . . . . . . . . . . 80.8 t -44.99 -43.97 2.72 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.418 0 C-N-CA 125.019 1.328 . . . . 0.0 112.804 -177.74 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 42' ' ' SER . . . . . . . . . . . . . 9.8 p -65.48 -42.77 91.85 Favored 'General case' 0 CA--C 1.542 0.642 0 CA-C-N 119.256 0.935 . . . . 0.0 112.276 179.474 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -66.31 -45.39 80.53 Favored 'General case' 0 C--O 1.226 -0.183 0 C-N-CA 125.545 1.538 . . . . 0.0 108.921 178.941 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 44' ' ' TYR . . . . . . . . . . . . . 72.3 t80 -56.25 -51.31 68.6 Favored 'General case' 0 N--CA 1.443 -0.781 0 C-N-CA 125.685 1.594 . . . . 0.0 109.256 179.627 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 45' ' ' ILE . . . . . . . . . . . . . 9.0 mm -56.12 -58.94 3.41 Favored 'Isoleucine or valine' 0 C--N 1.34 0.162 0 C-N-CA 123.427 0.691 . . . . 0.0 110.952 179.561 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 46' ' ' ARG . . . . . . . . . . . . . 13.3 ptm180 -57.52 -48.97 77.84 Favored 'General case' 0 C--O 1.221 -0.426 0 CA-C-O 118.213 -0.898 . . . . 0.0 111.113 -178.832 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 47' ' ' ASN . . . . . . . . . . . . . 20.1 t30 -55.4 -55.94 25.89 Favored 'General case' 0 N--CA 1.452 -0.349 0 CA-C-N 118.935 0.789 . . . . 0.0 110.837 -179.493 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -59.9 -26.8 66.2 Favored 'General case' 0 CA--C 1.531 0.245 0 C-N-CA 123.529 0.732 . . . . 0.0 112.816 -179.486 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 49' ' ' ALA . . . . . . . . . . . . . . . -84.29 -12.48 54.59 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 124.176 0.991 . . . . 0.0 113.073 179.746 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 14.2 mt -109.99 -30.06 7.96 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 118.856 0.753 . . . . 0.0 111.481 179.749 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 51' ' ' ASN . . . . . . . . . . . . . 11.8 m-80 . . . . . 0 C--O 1.249 1.048 0 C-N-CA 126.057 1.743 . . . . 0.0 109.805 -178.815 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 3.4 p . . . . . 0 N--CA 1.469 0.488 0 CA-C-O 120.729 0.3 . . . . 0.0 111.204 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -156.47 177.45 11.45 Favored 'General case' 0 C--O 1.234 0.267 0 C-N-CA 125.084 1.354 . . . . 0.0 107.968 178.849 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 5.7 m -150.51 168.87 22.94 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 106.999 -1.482 . . . . 0.0 106.999 178.47 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -55.62 -71.34 0.09 Allowed 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 123.355 0.662 . . . . 0.0 110.62 -179.916 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 27.6 m -76.28 7.26 0.71 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.694 0 C-N-CA 124.783 1.233 . . . . 0.0 113.582 -179.656 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 49.8 mtt180 -141.52 80.0 1.71 Allowed 'General case' 0 N--CA 1.465 0.303 0 O-C-N 120.211 -1.556 . . . . 0.0 108.553 179.772 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . 0.425 ' HB2' ' HZ3' ' A' ' 7' ' ' LYS . 1.5 ttmp? -130.35 24.32 5.17 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 124.542 1.137 . . . . 0.0 110.531 -179.785 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.59 8.6 0.81 Allowed 'General case' 0 CA--C 1.539 0.549 0 O-C-N 120.772 -1.205 . . . . 0.0 113.029 179.375 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -62.71 -56.45 17.54 Favored 'General case' 0 N--CA 1.449 -0.486 0 C-N-CA 126.043 1.737 . . . . 0.0 110.495 179.454 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 20.3 tt0 -158.84 164.2 35.95 Favored 'General case' 0 C--O 1.237 0.399 0 C-N-CA 124.825 1.25 . . . . 0.0 109.223 -179.439 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 20.1 t -133.84 -89.43 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.451 -0.414 0 C-N-CA 126.02 1.728 . . . . 0.0 106.509 178.902 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 8.0 ptm180 -157.7 161.3 38.54 Favored 'General case' 0 C--O 1.238 0.45 0 C-N-CA 127.942 2.497 . . . . 0.0 107.343 -179.531 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 28.3 mm-40 -78.82 91.81 4.78 Favored 'General case' 0 C--N 1.332 -0.182 0 N-CA-C 106.302 -1.74 . . . . 0.0 106.302 178.772 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 18.7 ptmt -57.49 -47.36 82.1 Favored 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 123.959 0.904 . . . . 0.0 108.886 179.211 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 8.4 t -79.34 155.8 28.28 Favored 'General case' 0 N--CA 1.434 -1.254 0 N-CA-C 108.59 -0.893 . . . . 0.0 108.59 179.467 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 2.5 t -103.92 134.34 45.44 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.801 0 N-CA-C 104.763 -2.31 . . . . 0.0 104.763 178.344 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 8.8 p -127.32 111.63 25.87 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 N-CA-C 106.295 -1.743 . . . . 0.0 106.295 179.102 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 61.6 ttm-85 -141.68 157.7 44.74 Favored 'General case' 0 CA--C 1.52 -0.206 0 CA-C-N 115.447 -0.797 . . . . 0.0 108.972 -179.807 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 45.0 m -95.7 110.03 22.23 Favored 'General case' 0 N--CA 1.448 -0.544 0 N-CA-C 104.62 -2.363 . . . . 0.0 104.62 178.674 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 12.6 tp -104.24 145.9 29.56 Favored 'General case' 0 C--O 1.237 0.428 0 N-CA-C 106.839 -1.541 . . . . 0.0 106.839 179.841 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 33.1 mtt180 -127.74 161.3 29.28 Favored 'General case' 0 N--CA 1.453 -0.298 0 C-N-CA 123.529 0.732 . . . . 0.0 110.306 -179.538 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 95.1 m-85 -149.49 159.03 44.65 Favored 'General case' 0 N--CA 1.465 0.298 0 C-N-CA 124.311 1.045 . . . . 0.0 108.818 -179.117 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -84.91 169.87 15.15 Favored Pre-proline 0 CA--C 1.542 0.658 0 N-CA-C 108.477 -0.935 . . . . 0.0 108.477 178.578 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -61.49 -32.64 88.5 Favored 'Trans proline' 0 C--N 1.349 0.602 0 C-N-CA 122.04 1.827 . . . . 0.0 111.811 -178.834 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 93.4 t -66.23 -58.38 6.86 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.419 0 C-N-CA 125.885 1.674 . . . . 0.0 108.511 179.526 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -56.66 -40.15 74.99 Favored 'General case' 0 CA--C 1.521 -0.148 0 CA-C-N 118.146 0.43 . . . . 0.0 111.389 -179.722 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 32.8 t70 -65.49 -42.68 91.89 Favored 'General case' 0 CA--C 1.512 -0.483 0 C-N-CA 123.989 0.916 . . . . 0.0 110.994 179.647 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 34.9 tt0 -60.28 -52.64 64.43 Favored 'General case' 0 N--CA 1.448 -0.56 0 N-CA-C 107.738 -1.208 . . . . 0.0 107.738 179.328 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 57.0 m -56.41 -56.46 20.92 Favored 'General case' 0 N--CA 1.451 -0.385 0 C-N-CA 123.046 0.538 . . . . 0.0 110.161 -179.194 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 27.8 mt -58.82 -43.38 88.02 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.536 0 N-CA-C 112.412 0.523 . . . . 0.0 112.412 -178.576 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 31.6 ttt180 -59.14 -47.0 86.9 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 118.616 0.644 . . . . 0.0 109.814 179.63 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 2.3 mptm? -66.72 -40.89 88.57 Favored 'General case' 0 CA--C 1.529 0.153 0 CA-C-O 119.456 -0.307 . . . . 0.0 110.248 -179.726 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 8.4 tptt -64.73 -44.41 90.26 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-N 118.994 0.815 . . . . 0.0 111.118 -179.361 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -61.55 -53.16 59.96 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 124.377 1.071 . . . . 0.0 111.12 -179.856 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 3.7 tp10 -65.18 -36.18 83.39 Favored 'General case' 0 C--O 1.233 0.227 0 N-CA-C 113.419 0.896 . . . . 0.0 113.419 -177.137 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 30.3 t70 -67.83 -40.88 83.73 Favored 'General case' 0 CA--C 1.517 -0.322 0 N-CA-C 109.894 -0.41 . . . . 0.0 109.894 179.112 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 9.4 t -75.7 -14.05 60.33 Favored 'General case' 0 N--CA 1.452 -0.326 0 CA-C-N 115.784 -0.643 . . . . 0.0 111.68 -179.337 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 71.92 39.89 58.39 Favored Glycine 0 CA--C 1.526 0.733 0 N-CA-C 108.955 -1.658 . . . . 0.0 108.955 -178.876 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 84.2 mt -128.32 137.1 51.79 Favored 'General case' 0 N--CA 1.448 -0.552 0 N-CA-C 103.109 -2.922 . . . . 0.0 103.109 179.021 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 5.7 t -70.6 155.67 40.44 Favored 'General case' 0 C--N 1.319 -0.728 0 N-CA-C 106.053 -1.832 . . . . 0.0 106.053 178.226 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 74.3 t -52.73 -40.93 36.79 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.452 0 O-C-N 121.033 -1.042 . . . . 0.0 111.988 -179.601 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 65.3 p -61.97 -46.85 87.44 Favored 'General case' 0 N--CA 1.468 0.431 0 CA-C-N 119.494 1.043 . . . . 0.0 110.921 -179.855 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.88 -45.04 91.16 Favored 'General case' 0 C--O 1.219 -0.51 0 N-CA-C 108.238 -1.023 . . . . 0.0 108.238 178.311 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 92.5 t80 -54.35 -48.85 70.96 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 123.806 0.842 . . . . 0.0 109.928 -179.835 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 5.1 mm -56.45 -65.32 0.4 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.241 0 C-N-CA 125.051 1.34 . . . . 0.0 110.88 179.667 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 10.6 ptt180 -57.53 -39.96 77.74 Favored 'General case' 0 C--O 1.22 -0.463 0 CA-C-O 118.898 -0.572 . . . . 0.0 110.442 -178.833 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 8.9 t30 -58.31 -56.98 15.09 Favored 'General case' 0 N--CA 1.453 -0.277 0 C-N-CA 124.07 0.948 . . . . 0.0 109.298 179.432 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -60.11 -34.2 73.17 Favored 'General case' 0 CA--C 1.532 0.264 0 CA-C-O 121.362 0.601 . . . . 0.0 111.132 -179.797 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -67.74 -26.84 66.34 Favored 'General case' 0 CA--C 1.538 0.508 0 O-C-N 121.283 -0.886 . . . . 0.0 113.187 -179.885 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 6.1 mt -100.4 -31.59 11.24 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-N 119.32 0.964 . . . . 0.0 112.069 -178.652 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 38.4 m-80 . . . . . 0 C--O 1.247 0.958 0 C-N-CA 124.712 1.205 . . . . 0.0 108.134 179.583 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 1' ' ' SER . . . . . . . . . . . . . 2.9 p . . . . . 0 N--CA 1.472 0.657 0 N-CA-C 109.651 -0.5 . . . . 0.0 109.651 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 2' ' ' ASP . . . . . . . . . . . . . 2.6 p-10 -164.15 -172.91 2.94 Favored 'General case' 0 N--CA 1.464 0.254 0 O-C-N 121.144 -0.972 . . . . 0.0 109.671 -179.532 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 3' ' ' SER . . . . . . . . . . . . . 58.6 m -158.09 154.66 27.89 Favored 'General case' 0 N--CA 1.448 -0.574 0 C-N-CA 127.62 2.368 . . . . 0.0 104.974 177.472 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 4' ' ' ALA . . . . . . . . . . . . . . . -53.31 -37.83 62.6 Favored 'General case' 0 CA--C 1.537 0.454 0 N-CA-C 112.727 0.64 . . . . 0.0 112.727 -179.525 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 9.8 p -103.98 3.51 10.58 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.721 0 C-N-CA 124.382 1.073 . . . . 0.0 112.489 -179.517 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 6' ' ' ARG . . . . . . . . . . . . . 33.9 mtt180 -131.88 68.94 1.48 Allowed 'General case' 0 N--CA 1.467 0.403 0 O-C-N 119.977 -1.702 . . . . 0.0 108.673 179.998 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 4.1 ttmp? -136.53 78.58 1.71 Allowed 'General case' 0 N--CA 1.45 -0.463 0 N-CA-C 105.734 -1.95 . . . . 0.0 105.734 178.907 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 6.3 mptt -125.04 6.25 7.93 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 125.705 1.602 . . . . 0.0 109.43 179.122 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 1.8 p -60.55 -64.86 0.8 Allowed 'General case' 0 N--CA 1.449 -0.479 0 C-N-CA 125.382 1.473 . . . . 0.0 109.951 -179.328 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 10' ' ' GLU . . . . . . . . . . . . . 7.9 tt0 -155.79 83.64 1.02 Allowed 'General case' 0 CA--C 1.534 0.349 0 N-CA-C 108.772 -0.825 . . . . 0.0 108.772 179.975 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 11' ' ' VAL . . . . . . . . . . . . . 60.1 t -62.19 -62.77 1.0 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.362 0 C-N-CA 123.337 0.655 . . . . 0.0 109.616 179.759 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 12' ' ' ARG . . . . . . . . . . . . . 26.6 ttm180 -170.26 147.32 3.08 Favored 'General case' 0 C--O 1.239 0.518 0 C-N-CA 126.279 1.831 . . . . 0.0 107.398 179.889 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 13' ' ' GLN . . . . . . . . . . . . . 58.0 mm-40 -78.34 94.25 4.81 Favored 'General case' 0 CA--C 1.516 -0.359 0 N-CA-C 103.791 -2.67 . . . . 0.0 103.791 177.727 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 40.7 pttt -68.83 -34.86 76.2 Favored 'General case' 0 N--CA 1.449 -0.514 0 N-CA-C 108.253 -1.017 . . . . 0.0 108.253 178.925 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 6.0 t -74.65 154.38 38.52 Favored 'General case' 0 N--CA 1.437 -1.09 0 N-CA-C 107.066 -1.457 . . . . 0.0 107.066 178.09 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 2.4 t -101.07 154.39 4.68 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.911 0 N-CA-C 103.77 -2.678 . . . . 0.0 103.77 177.278 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 11.2 p -145.81 115.39 1.56 Allowed 'Isoleucine or valine' 0 N--CA 1.444 -0.73 0 N-CA-C 106.524 -1.658 . . . . 0.0 106.524 179.468 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 49.0 ttm-85 -152.96 161.19 42.84 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.615 0.721 . . . . 0.0 110.721 -179.63 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -96.92 110.88 23.3 Favored 'General case' 0 N--CA 1.446 -0.646 0 N-CA-C 105.484 -2.043 . . . . 0.0 105.484 179.219 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -109.17 108.89 19.7 Favored 'General case' 0 C--O 1.236 0.357 0 N-CA-C 106.537 -1.653 . . . . 0.0 106.537 -179.887 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 5.7 mtp180 -87.37 153.28 21.57 Favored 'General case' 0 C--N 1.334 -0.065 0 C-N-CA 122.73 0.412 . . . . 0.0 110.254 -179.916 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 22' ' ' PHE . . . . . . . . . . . . . 87.7 m-85 -141.2 143.77 34.39 Favored 'General case' 0 N--CA 1.468 0.471 0 N-CA-C 107.97 -1.122 . . . . 0.0 107.97 179.921 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 1.2 m -74.1 167.03 39.41 Favored Pre-proline 0 CA--C 1.538 0.499 0 CA-C-O 118.254 -0.879 . . . . 0.0 108.986 179.882 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 24' ' ' PRO . . . . . . . . . . . . . 61.0 Cg_endo -67.97 -33.2 26.71 Favored 'Trans proline' 0 C--N 1.346 0.427 0 C-N-CA 121.91 1.74 . . . . 0.0 112.283 -179.181 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 25' ' ' VAL . . . . . . . . . . . . . 61.9 t -64.8 -52.02 59.61 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.413 0 N-CA-C 107.847 -1.168 . . . . 0.0 107.847 179.637 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 1.4 mp0 -63.32 -44.55 94.62 Favored 'General case' 0 C--O 1.222 -0.368 0 C-N-CA 124.156 0.982 . . . . 0.0 110.477 179.276 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 27' ' ' ASP . . . . . . . . . . . . . 6.7 t70 -57.13 -45.22 83.67 Favored 'General case' 0 C--O 1.223 -0.298 0 C-N-CA 125.714 1.606 . . . . 0.0 111.446 -179.685 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 28' ' ' GLU . . . . . . . . . . . . . 46.3 tt0 -63.42 -46.52 85.98 Favored 'General case' 0 N--CA 1.448 -0.549 0 N-CA-C 108.614 -0.884 . . . . 0.0 108.614 178.866 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 52.0 m -62.27 -47.87 82.43 Favored 'General case' 0 C--N 1.333 -0.11 0 O-C-N 121.695 -0.628 . . . . 0.0 110.524 179.226 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 79.2 mt -63.37 -38.4 82.07 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.634 0 CA-C-O 122.415 1.102 . . . . 0.0 108.399 179.759 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 70.0 ttt180 -64.66 -38.3 90.52 Favored 'General case' 0 C--N 1.327 -0.378 0 O-C-N 118.881 -2.387 . . . . 0.0 109.29 178.226 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -71.8 -48.22 47.94 Favored 'General case' 0 C--N 1.33 -0.262 0 C-N-CA 123.937 0.895 . . . . 0.0 112.462 -179.151 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 12.7 mptt -66.45 -46.11 77.53 Favored 'General case' 0 C--O 1.225 -0.221 0 CA-C-O 118.026 -0.988 . . . . 0.0 108.604 -179.857 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 34' ' ' ALA . . . . . . . . . . . . . . . -53.7 -56.31 18.45 Favored 'General case' 0 CA--C 1.528 0.123 0 CA-C-N 119.317 0.962 . . . . 0.0 110.183 179.284 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 5.2 tp10 -63.17 -39.28 94.19 Favored 'General case' 0 C--O 1.232 0.153 0 N-CA-C 112.578 0.585 . . . . 0.0 112.578 -178.303 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 36' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -69.3 -35.57 76.12 Favored 'General case' 0 N--CA 1.46 0.055 0 CA-C-N 118.453 0.57 . . . . 0.0 110.355 179.622 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 37' ' ' SER . . . . . . . . . . . . . 13.9 t -75.92 -12.14 60.09 Favored 'General case' 0 CA--C 1.541 0.628 0 N-CA-C 108.911 -0.774 . . . . 0.0 108.911 178.234 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 75.44 29.6 59.68 Favored Glycine 0 C--N 1.339 0.696 0 O-C-N 121.126 -0.984 . . . . 0.0 110.74 -179.504 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 39' ' ' LEU . . . . . . . . . . . . . 87.6 mt -120.9 159.05 26.32 Favored 'General case' 0 N--CA 1.445 -0.71 0 C-N-CA 125.469 1.508 . . . . 0.0 107.929 179.425 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 40' ' ' THR . . . . . 0.438 HG21 ' H ' ' B' ' 43' ' ' ALA . 1.6 t -81.39 151.9 27.71 Favored 'General case' 0 C--N 1.322 -0.609 0 N-CA-C 104.109 -2.552 . . . . 0.0 104.109 176.799 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 41' ' ' VAL . . . . . . . . . . . . . 42.2 t -48.17 -42.09 10.73 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.659 0 C-N-CA 125.217 1.407 . . . . 0.0 109.627 178.516 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 42' ' ' SER . . . . . . . . . . . . . 13.2 p -60.37 -51.08 71.04 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-N 119.648 1.113 . . . . 0.0 111.39 179.465 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 43' ' ' ALA . . . . . 0.438 ' H ' HG21 ' B' ' 40' ' ' THR . . . -61.04 -42.85 99.25 Favored 'General case' 0 C--O 1.223 -0.302 0 C-N-CA 123.601 0.761 . . . . 0.0 109.023 179.193 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 44' ' ' TYR . . . . . . . . . . . . . 46.8 t80 -58.39 -50.63 72.98 Favored 'General case' 0 N--CA 1.445 -0.709 0 N-CA-C 109.444 -0.576 . . . . 0.0 109.444 179.486 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 45' ' ' ILE . . . . . . . . . . . . . 22.7 mm -55.44 -61.03 1.21 Allowed 'Isoleucine or valine' 0 C--N 1.34 0.189 0 C-N-CA 124.036 0.934 . . . . 0.0 110.214 179.762 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 46' ' ' ARG . . . . . . . . . . . . . 26.9 ptt180 -53.92 -49.11 69.37 Favored 'General case' 0 C--O 1.223 -0.33 0 CA-C-O 118.967 -0.54 . . . . 0.0 111.384 -178.566 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 47' ' ' ASN . . . . . . . . . . . . . 24.0 t30 -60.34 -51.76 68.14 Favored 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 124.195 0.998 . . . . 0.0 112.692 -179.075 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -61.45 -35.57 77.97 Favored 'General case' 0 C--O 1.222 -0.344 0 O-C-N 123.82 0.7 . . . . 0.0 111.528 -179.858 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 49' ' ' ALA . . . . . . . . . . . . . . . -77.07 -24.25 51.92 Favored 'General case' 0 N--CA 1.447 -0.595 0 N-CA-C 113.575 0.954 . . . . 0.0 113.575 -178.79 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 24.8 mt -84.96 -40.75 16.58 Favored 'General case' 0 CA--C 1.513 -0.47 0 CA-C-N 118.734 0.697 . . . . 0.0 111.172 -179.671 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 51' ' ' ASN . . . . . . . . . . . . . 69.5 m-80 . . . . . 0 C--O 1.247 0.924 0 CA-C-O 116.301 -1.809 . . . . 0.0 108.952 179.808 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 1.4 m . . . . . 0 N--CA 1.467 0.395 0 N-CA-C 108.361 -0.977 . . . . 0.0 108.361 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 39.5 t0 -164.78 177.72 7.75 Favored 'General case' 0 CA--C 1.547 0.844 0 C-N-CA 131.31 3.844 . . . . 0.0 102.358 -179.448 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 50.4 m -147.51 119.9 8.43 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 119.367 -2.083 . . . . 0.0 106.426 -179.432 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -51.23 -30.11 16.42 Favored 'General case' 0 CA--C 1.536 0.428 0 N-CA-C 112.819 0.674 . . . . 0.0 112.819 -178.881 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 30.9 m -66.98 5.48 0.33 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.649 0 C-N-CA 126.267 1.827 . . . . 0.0 113.124 179.108 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 34.9 ttp85 -61.82 -7.8 4.09 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 125.317 1.447 . . . . 0.0 111.916 178.673 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -125.44 160.94 28.2 Favored 'General case' 0 C--O 1.234 0.245 0 C-N-CA 127.194 2.198 . . . . 0.0 106.148 177.612 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 29.7 pttt -141.99 110.92 6.25 Favored 'General case' 0 CA--C 1.52 -0.205 0 C-N-CA 123.178 0.591 . . . . 0.0 110.513 -179.121 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 9.1 p -80.08 -63.08 1.49 Allowed 'General case' 0 CA--C 1.532 0.27 0 N-CA-C 108.774 -0.824 . . . . 0.0 108.774 179.299 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 39.6 tt0 -61.44 149.28 39.06 Favored 'General case' 0 C--O 1.236 0.373 0 C-N-CA 125.018 1.327 . . . . 0.0 110.638 179.804 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 12.1 p -142.89 144.05 24.58 Favored 'Isoleucine or valine' 0 C--O 1.236 0.385 0 C-N-CA 126.274 1.829 . . . . 0.0 106.086 177.549 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -146.08 163.77 34.23 Favored 'General case' 0 CA--C 1.51 -0.562 0 N-CA-C 108.13 -1.063 . . . . 0.0 108.13 178.827 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 37.6 mm-40 -82.89 70.25 9.86 Favored 'General case' 0 CA--C 1.531 0.217 0 N-CA-C 107.005 -1.479 . . . . 0.0 107.005 178.936 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 16.0 ptmt -63.57 -38.64 91.9 Favored 'General case' 0 N--CA 1.457 -0.092 0 C-N-CA 127.384 2.274 . . . . 0.0 109.162 179.125 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 5.3 t -79.3 169.86 17.49 Favored 'General case' 0 N--CA 1.432 -1.364 0 C-N-CA 126.06 1.744 . . . . 0.0 108.457 179.163 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 16.0 t -101.77 157.61 4.46 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.578 0 N-CA-C 106.445 -1.687 . . . . 0.0 106.445 178.611 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 7.2 p -151.16 107.58 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 N-CA-C 105.723 -1.954 . . . . 0.0 105.723 178.05 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 4.2 ttt85 -152.66 146.63 25.31 Favored 'General case' 0 C--O 1.235 0.334 0 O-C-N 122.085 -0.385 . . . . 0.0 111.669 -178.954 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -76.97 119.03 20.14 Favored 'General case' 0 N--CA 1.449 -0.484 0 N-CA-C 104.739 -2.319 . . . . 0.0 104.739 177.212 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 13.0 tp -123.62 113.14 18.28 Favored 'General case' 0 N--CA 1.442 -0.835 0 C-N-CA 123.275 0.63 . . . . 0.0 109.371 179.788 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 7.7 mtm180 -98.31 162.24 13.28 Favored 'General case' 0 N--CA 1.453 -0.281 0 C-N-CA 125.629 1.572 . . . . 0.0 111.384 179.846 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 78.0 m-85 -144.24 150.99 38.81 Favored 'General case' 0 CA--C 1.53 0.208 0 C-N-CA 125.817 1.647 . . . . 0.0 107.004 179.421 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -75.26 175.43 4.08 Favored Pre-proline 0 CA--C 1.551 1.012 0 CA-C-N 119.83 1.195 . . . . 0.0 108.859 179.329 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . 0.428 ' HG3' ' HE3' ' B' ' 14' ' ' LYS . 43.6 Cg_endo -66.71 -43.38 7.43 Favored 'Trans proline' 0 C--N 1.35 0.634 0 CA-C-N 122.144 1.802 . . . . 0.0 113.067 -178.67 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 96.3 t -64.38 -41.71 93.17 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.218 0 N-CA-C 108.615 -0.883 . . . . 0.0 108.615 179.893 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -63.39 -47.75 80.73 Favored 'General case' 0 N--CA 1.452 -0.364 0 C-N-CA 123.664 0.785 . . . . 0.0 109.284 179.911 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 5.5 t70 -59.71 -49.91 75.91 Favored 'General case' 0 CA--C 1.507 -0.688 0 C-N-CA 125.837 1.655 . . . . 0.0 111.847 -179.898 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -62.29 -44.41 96.59 Favored 'General case' 0 N--CA 1.447 -0.613 0 N-CA-C 108.123 -1.066 . . . . 0.0 108.123 -179.64 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 30.8 m -61.17 -53.36 57.94 Favored 'General case' 0 N--CA 1.454 -0.265 0 N-CA-C 108.698 -0.852 . . . . 0.0 108.698 178.872 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 58.1 mt -58.16 -43.61 85.93 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.329 0 CA-C-N 119.038 0.835 . . . . 0.0 110.211 -179.644 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 23.2 ttt180 -63.22 -47.67 81.53 Favored 'General case' 0 C--N 1.332 -0.161 0 O-C-N 121.457 -0.777 . . . . 0.0 110.089 179.91 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 4.7 mptp? -63.71 -46.4 85.61 Favored 'General case' 0 C--O 1.225 -0.229 0 CA-C-N 118.82 0.736 . . . . 0.0 109.796 -179.786 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 13.5 mptt -64.82 -44.67 89.11 Favored 'General case' 0 CA--C 1.529 0.143 0 CA-C-O 118.057 -0.973 . . . . 0.0 110.237 -179.566 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -57.37 -56.14 25.67 Favored 'General case' 0 C--O 1.231 0.1 0 C-N-CA 124.656 1.183 . . . . 0.0 109.609 179.018 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 29.9 tt0 -60.63 -40.9 93.67 Favored 'General case' 0 N--CA 1.449 -0.488 0 C-N-CA 123.633 0.773 . . . . 0.0 112.132 -178.269 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 27.6 t70 -68.3 -30.27 69.22 Favored 'General case' 0 CA--C 1.53 0.173 0 C-N-CA 124.349 1.06 . . . . 0.0 110.138 179.449 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 10.1 t -82.18 -6.41 59.18 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 124.58 1.152 . . . . 0.0 109.375 178.153 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 69.2 29.27 72.12 Favored Glycine 0 CA--C 1.527 0.789 0 O-C-N 120.581 -1.325 . . . . 0.0 109.991 -179.265 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 75.9 mt -122.68 158.83 29.2 Favored 'General case' 0 N--CA 1.447 -0.597 0 C-N-CA 125.836 1.654 . . . . 0.0 108.137 179.99 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -84.91 147.49 26.73 Favored 'General case' 0 C--N 1.32 -0.704 0 N-CA-C 104.036 -2.579 . . . . 0.0 104.036 177.235 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 39.8 t -46.8 -41.05 5.06 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.478 0 C-N-CA 125.356 1.463 . . . . 0.0 110.241 178.494 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -60.75 -49.44 77.48 Favored 'General case' 0 CA--C 1.548 0.873 0 CA-C-N 119.622 1.101 . . . . 0.0 110.587 179.515 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -64.47 -41.84 96.26 Favored 'General case' 0 C--O 1.224 -0.261 0 C-N-CA 125.229 1.411 . . . . 0.0 110.203 178.898 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 81.3 t80 -58.35 -52.54 65.19 Favored 'General case' 0 N--CA 1.452 -0.347 0 N-CA-C 108.087 -1.079 . . . . 0.0 108.087 179.256 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 16.6 mm -52.44 -59.8 1.4 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.298 0 C-N-CA 124.227 1.011 . . . . 0.0 110.698 179.499 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 29.5 ptt180 -59.05 -44.17 91.76 Favored 'General case' 0 C--O 1.222 -0.381 0 CA-C-O 118.72 -0.657 . . . . 0.0 112.304 -178.944 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 29.4 t30 -59.91 -52.35 65.8 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-N 118.657 0.662 . . . . 0.0 110.808 -178.922 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -62.99 -29.21 70.64 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 123.649 0.78 . . . . 0.0 111.502 179.438 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -80.5 -15.41 56.77 Favored 'General case' 0 CA--C 1.532 0.283 0 N-CA-C 113.791 1.034 . . . . 0.0 113.791 -179.677 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 31.0 mt -101.96 -42.89 5.95 Favored 'General case' 0 CA--C 1.522 -0.131 0 CA-C-N 120.173 1.351 . . . . 0.0 112.124 -179.606 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 60.8 m-80 . . . . . 0 C--O 1.245 0.836 0 O-C-N 124.159 0.912 . . . . 0.0 109.487 -179.437 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 1' ' ' SER . . . . . . . . . . . . . 8.7 m . . . . . 0 N--CA 1.467 0.386 0 N-CA-C 107.748 -1.205 . . . . 0.0 107.748 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 2' ' ' ASP . . . . . . . . . . . . . 1.8 p-10 -153.19 -143.07 0.12 Allowed 'General case' 0 CA--C 1.542 0.656 0 N-CA-C 104.769 -2.308 . . . . 0.0 104.769 179.605 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 3' ' ' SER . . . . . . . . . . . . . 16.7 m -151.85 120.4 6.46 Favored 'General case' 0 N--CA 1.45 -0.429 0 CA-C-N 121.404 1.911 . . . . 0.0 107.415 179.013 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 4' ' ' ALA . . . . . . . . . . . . . . . -57.3 -32.38 66.59 Favored 'General case' 0 CA--C 1.538 0.495 0 O-C-N 121.851 -0.531 . . . . 0.0 110.919 179.352 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 30.5 m -69.52 12.59 0.12 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.722 0 C-N-CA 127.061 2.144 . . . . 0.0 112.535 179.062 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 6' ' ' ARG . . . . . . . . . . . . . 20.0 ttp85 -67.27 2.39 1.66 Allowed 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 126.998 2.119 . . . . 0.0 112.315 178.951 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -142.35 165.23 27.98 Favored 'General case' 0 C--O 1.239 0.538 0 C-N-CA 128.833 2.853 . . . . 0.0 104.424 178.029 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 16.8 pttt -141.71 111.63 6.73 Favored 'General case' 0 CA--C 1.519 -0.238 0 N-CA-C 113.314 0.857 . . . . 0.0 113.314 -178.315 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 5.3 p -70.08 -8.53 50.21 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 125.151 1.38 . . . . 0.0 110.856 178.328 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 10' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -145.84 157.9 43.89 Favored 'General case' 0 N--CA 1.444 -0.74 0 C-N-CA 124.486 1.115 . . . . 0.0 111.839 -178.701 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 11' ' ' VAL . . . . . . . . . . . . . 28.7 m -142.99 146.07 22.13 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 N-CA-C 103.75 -2.685 . . . . 0.0 103.75 177.569 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 12' ' ' ARG . . . . . . . . . . . . . 65.6 mtp85 -133.76 169.27 17.29 Favored 'General case' 0 C--O 1.245 0.822 0 N-CA-C 107.919 -1.141 . . . . 0.0 107.919 -179.46 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 13' ' ' GLN . . . . . . . . . . . . . 55.6 mm-40 -84.96 60.14 6.05 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 122.033 0.92 . . . . 0.0 109.017 178.69 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 14' ' ' LYS . . . . . 0.428 ' HE3' ' HG3' ' A' ' 24' ' ' PRO . 22.1 ptmt -61.22 -23.29 65.51 Favored 'General case' 0 C--O 1.223 -0.305 0 C-N-CA 125.611 1.564 . . . . 0.0 110.733 178.526 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 5.4 t -82.34 -171.17 3.3 Favored 'General case' 0 N--CA 1.436 -1.126 0 C-N-CA 125.072 1.349 . . . . 0.0 109.73 179.802 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 23.2 t -122.85 143.82 34.45 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.615 0 N-CA-C 105.537 -2.023 . . . . 0.0 105.537 179.234 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 6.4 p -143.74 97.66 0.58 Allowed 'Isoleucine or valine' 0 N--CA 1.443 -0.784 0 CA-C-O 122.471 1.129 . . . . 0.0 109.564 178.761 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 1.2 ttt85 -144.18 155.05 43.74 Favored 'General case' 0 N--CA 1.45 -0.463 0 CA-C-N 114.617 -1.174 . . . . 0.0 108.372 179.292 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -90.87 134.76 34.21 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 104.096 -2.557 . . . . 0.0 104.096 177.559 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 11.3 tp -116.04 154.92 29.04 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-N 118.883 0.765 . . . . 0.0 109.673 179.497 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 18.4 mmt180 -126.54 150.28 48.89 Favored 'General case' 0 C--O 1.232 0.17 0 C-N-CA 125.762 1.625 . . . . 0.0 110.203 -178.93 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 22' ' ' PHE . . . . . . . . . . . . . 91.9 m-85 -145.82 143.91 29.94 Favored 'General case' 0 C--O 1.232 0.165 0 C-N-CA 125.587 1.555 . . . . 0.0 107.366 178.578 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 2.4 m -68.99 170.84 7.57 Favored Pre-proline 0 CA--C 1.542 0.652 0 CA-C-N 119.258 0.935 . . . . 0.0 109.997 179.323 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 24' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_endo -65.75 -44.81 7.43 Favored 'Trans proline' 0 C--N 1.349 0.584 0 C-N-CA 121.452 1.435 . . . . 0.0 113.139 -178.277 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 25' ' ' VAL . . . . . . . . . . . . . 21.8 t -65.87 -38.99 83.43 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.52 0 C-N-CA 123.918 0.887 . . . . 0.0 109.387 179.788 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 98.6 mt-10 -66.5 -40.93 89.52 Favored 'General case' 0 C--O 1.226 -0.173 0 C-N-CA 123.879 0.872 . . . . 0.0 108.858 179.488 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 27' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -62.89 -50.26 71.6 Favored 'General case' 0 CA--C 1.514 -0.412 0 C-N-CA 123.903 0.881 . . . . 0.0 109.518 179.195 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 28' ' ' GLU . . . . . . . . . . . . . 91.4 mt-10 -57.02 -43.35 81.78 Favored 'General case' 0 C--N 1.332 -0.191 0 C-N-CA 124.245 1.018 . . . . 0.0 109.542 178.689 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 80.0 m -63.23 -59.92 4.09 Favored 'General case' 0 N--CA 1.451 -0.421 0 N-CA-C 109.599 -0.519 . . . . 0.0 109.599 179.52 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 98.0 mt -58.09 -39.07 71.03 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.449 0 C-N-CA 123.961 0.904 . . . . 0.0 111.891 -178.686 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 24.1 ttt-85 -67.08 -48.4 68.34 Favored 'General case' 0 N--CA 1.453 -0.277 0 O-C-N 121.399 -0.813 . . . . 0.0 108.977 -179.855 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 2.1 mptp? -60.94 -46.98 88.52 Favored 'General case' 0 CA--C 1.515 -0.386 0 N-CA-C 108.82 -0.807 . . . . 0.0 108.82 -179.89 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 58.7 mmtt -63.59 -43.91 95.56 Favored 'General case' 0 C--O 1.22 -0.448 0 CA-C-O 118.053 -0.975 . . . . 0.0 110.619 -179.498 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 34' ' ' ALA . . . . . . . . . . . . . . . -58.21 -50.94 71.79 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 119.6 1.091 . . . . 0.0 109.237 178.618 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 27.6 tt0 -60.06 -45.03 94.23 Favored 'General case' 0 N--CA 1.454 -0.255 0 C-N-CA 124.144 0.977 . . . . 0.0 111.779 -179.185 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 36' ' ' ASP . . . . . . . . . . . . . 25.3 t0 -68.73 -37.53 79.53 Favored 'General case' 0 C--N 1.331 -0.215 0 C-N-CA 125.332 1.453 . . . . 0.0 110.418 -179.362 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 37' ' ' SER . . . . . . . . . . . . . 32.8 t -73.0 -11.2 60.48 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 126.409 1.884 . . . . 0.0 110.04 178.723 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 68.33 26.89 74.02 Favored Glycine 0 CA--C 1.525 0.689 0 O-C-N 121.246 -0.909 . . . . 0.0 111.259 -179.447 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 39' ' ' LEU . . . . . . . . . . . . . 82.2 mt -121.17 142.29 50.03 Favored 'General case' 0 N--CA 1.445 -0.678 0 C-N-CA 125.2 1.4 . . . . 0.0 107.588 -179.717 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 40' ' ' THR . . . . . . . . . . . . . 2.0 t -64.61 146.31 54.86 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 105.367 -2.086 . . . . 0.0 105.367 177.036 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 41' ' ' VAL . . . . . . . . . . . . . 2.2 t -45.94 -51.27 3.65 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.469 0 C-N-CA 124.748 1.219 . . . . 0.0 111.538 179.303 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 42' ' ' SER . . . . . . . . . . . . . 1.5 p -58.09 -31.54 67.21 Favored 'General case' 0 CA--C 1.544 0.741 0 O-C-N 120.325 -1.485 . . . . 0.0 112.686 -179.199 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -78.46 -40.8 34.57 Favored 'General case' 0 C--O 1.224 -0.256 0 C-N-CA 124.694 1.198 . . . . 0.0 109.047 177.71 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 44' ' ' TYR . . . . . . . . . . . . . 24.6 t80 -57.37 -51.85 67.74 Favored 'General case' 0 N--CA 1.455 -0.224 0 N-CA-C 108.409 -0.959 . . . . 0.0 108.409 179.442 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 45' ' ' ILE . . . . . . . . . . . . . 28.0 mm -54.16 -60.67 1.27 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.309 0 C-N-CA 123.358 0.663 . . . . 0.0 111.676 179.499 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 46' ' ' ARG . . . . . . . . . . . . . 9.9 ptt180 -56.48 -43.19 79.39 Favored 'General case' 0 C--O 1.224 -0.264 0 CA-C-O 119.171 -0.442 . . . . 0.0 111.23 -178.519 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 47' ' ' ASN . . . . . . . . . . . . . 39.0 t30 -60.41 -55.93 27.63 Favored 'General case' 0 N--CA 1.446 -0.642 0 C-N-CA 123.885 0.874 . . . . 0.0 111.944 -179.198 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -60.2 -33.33 72.09 Favored 'General case' 0 CA--C 1.53 0.185 0 O-C-N 124.17 0.919 . . . . 0.0 112.564 -179.069 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 49' ' ' ALA . . . . . . . . . . . . . . . -74.0 -24.33 59.57 Favored 'General case' 0 C--N 1.333 -0.145 0 N-CA-C 113.986 1.106 . . . . 0.0 113.986 -178.929 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 24.0 mt -100.19 -43.13 6.41 Favored 'General case' 0 CA--C 1.514 -0.407 0 N-CA-C 113.423 0.897 . . . . 0.0 113.423 -178.672 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 51' ' ' ASN . . . . . . . . . . . . . 26.6 m-80 . . . . . 0 C--O 1.249 1.062 0 C-N-CA 125.179 1.392 . . . . 0.0 107.649 -177.514 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 30.3 t . . . . . 0 N--CA 1.466 0.359 0 N-CA-C 104.068 -2.567 . . . . 0.0 104.068 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 11.7 p-10 -59.44 -41.46 89.68 Favored 'General case' 0 C--N 1.328 -0.344 0 C-N-CA 129.158 2.983 . . . . 0.0 109.471 177.662 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 13.9 t -153.11 -177.58 6.4 Favored 'General case' 0 N--CA 1.444 -0.751 0 C-N-CA 125.174 1.389 . . . . 0.0 109.432 -179.324 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -163.7 93.58 0.74 Allowed 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 128.346 2.658 . . . . 0.0 107.51 179.448 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 13.5 p -67.05 -30.03 48.15 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.699 0 O-C-N 121.613 -0.679 . . . . 0.0 111.694 179.697 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 48.7 ttt85 -67.54 149.36 50.25 Favored 'General case' 0 C--N 1.341 0.23 0 N-CA-C 108.174 -1.047 . . . . 0.0 108.174 179.497 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 1.7 pttm -137.01 173.74 11.37 Favored 'General case' 0 C--O 1.237 0.437 0 C-N-CA 123.855 0.862 . . . . 0.0 111.36 -178.223 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 53.6 mtmt -122.05 28.88 7.31 Favored 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 126.3 1.84 . . . . 0.0 111.413 -178.979 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 1.6 p -73.16 -16.17 61.44 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 124.617 1.167 . . . . 0.0 112.033 179.427 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 7.6 mt-10 -73.6 94.81 2.21 Favored 'General case' 0 C--N 1.34 0.176 0 C-N-CA 124.048 0.939 . . . . 0.0 109.023 -179.996 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 6.1 m -67.85 -15.81 20.19 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 C-N-CA 126.238 1.815 . . . . 0.0 114.367 -179.882 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 4.9 tmm_? -61.49 130.89 48.21 Favored 'General case' 0 C--O 1.237 0.407 0 CA-C-N 119.974 1.261 . . . . 0.0 108.72 -179.637 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 23.5 mm100 -52.87 99.49 0.02 OUTLIER 'General case' 0 C--O 1.233 0.221 0 C-N-CA 125.757 1.623 . . . . 0.0 109.524 179.749 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 33.7 pttt -73.18 -24.55 60.56 Favored 'General case' 0 N--CA 1.463 0.193 0 C-N-CA 125.126 1.37 . . . . 0.0 111.847 -179.25 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 4.7 t -72.15 -174.89 1.36 Allowed 'General case' 0 N--CA 1.446 -0.635 0 N-CA-C 107.266 -1.383 . . . . 0.0 107.266 177.835 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 13.5 t -131.32 157.98 43.26 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 N-CA-C 106.01 -1.848 . . . . 0.0 106.01 -179.673 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 13.6 p -149.16 116.98 0.9 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.444 0 N-CA-C 106.881 -1.525 . . . . 0.0 106.881 178.898 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 25.1 ttt180 -153.26 161.22 42.63 Favored 'General case' 0 N--CA 1.466 0.339 0 O-C-N 121.691 -0.631 . . . . 0.0 110.153 -179.847 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -106.32 127.79 53.51 Favored 'General case' 0 C--O 1.24 0.58 0 N-CA-C 105.052 -2.203 . . . . 0.0 105.052 179.102 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -128.24 120.31 26.92 Favored 'General case' 0 CA--C 1.529 0.162 0 C-N-CA 124.284 1.034 . . . . 0.0 109.602 -178.448 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 15.6 mmt85 -83.84 156.97 22.2 Favored 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 124.811 1.244 . . . . 0.0 110.665 -179.768 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 70.6 m-85 -144.61 155.31 43.56 Favored 'General case' 0 N--CA 1.463 0.224 0 C-N-CA 125.355 1.462 . . . . 0.0 108.315 178.55 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 39.1 m -79.9 171.08 13.34 Favored Pre-proline 0 CA--C 1.545 0.783 0 C-N-CA 123.976 0.91 . . . . 0.0 108.904 179.095 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 35.0 Cg_endo -64.75 -54.61 0.68 Allowed 'Trans proline' 0 C--N 1.351 0.674 0 C-N-CA 121.961 1.774 . . . . 0.0 112.027 -178.012 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 33.7 t -58.91 -42.02 84.68 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.337 0 C-N-CA 123.359 0.664 . . . . 0.0 110.013 -179.716 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -63.55 -50.24 70.29 Favored 'General case' 0 C--O 1.227 -0.092 0 C-N-CA 123.289 0.635 . . . . 0.0 110.856 -179.576 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 7.1 t70 -59.65 -47.04 87.18 Favored 'General case' 0 C--O 1.221 -0.398 0 C-N-CA 123.859 0.864 . . . . 0.0 110.224 179.218 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 44.8 tt0 -58.18 -44.71 88.15 Favored 'General case' 0 N--CA 1.449 -0.523 0 C-N-CA 124.628 1.171 . . . . 0.0 109.217 179.945 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 68.7 m -60.42 -52.18 66.32 Favored 'General case' 0 CA--C 1.538 0.51 0 N-CA-C 108.793 -0.818 . . . . 0.0 108.793 178.886 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 72.3 mt -59.26 -45.99 92.63 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.211 0 C-N-CA 123.379 0.672 . . . . 0.0 109.752 -179.684 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 62.8 ttt180 -61.06 -40.98 95.7 Favored 'General case' 0 C--O 1.234 0.255 0 C-N-CA 124.237 1.015 . . . . 0.0 110.308 -179.525 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -68.34 -52.65 31.0 Favored 'General case' 0 CA--C 1.52 -0.201 0 CA-C-N 118.644 0.656 . . . . 0.0 110.33 179.461 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 75.9 mttt -60.99 -43.44 98.85 Favored 'General case' 0 CA--C 1.518 -0.262 0 CA-C-N 119.021 0.828 . . . . 0.0 111.122 -178.584 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -56.82 -54.16 49.64 Favored 'General case' 0 N--CA 1.452 -0.337 0 C-N-CA 123.936 0.894 . . . . 0.0 109.477 179.235 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 31.3 tt0 -62.82 -41.46 99.33 Favored 'General case' 0 N--CA 1.455 -0.185 0 N-CA-C 112.908 0.707 . . . . 0.0 112.908 -178.516 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -62.95 -39.3 94.22 Favored 'General case' 0 N--CA 1.453 -0.309 0 C-N-CA 125.451 1.501 . . . . 0.0 108.574 179.449 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 8.7 t -78.89 -9.76 59.59 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 123.815 0.846 . . . . 0.0 109.967 177.776 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 64.71 27.08 71.51 Favored Glycine 0 N--CA 1.442 -0.928 0 C-N-CA 125.955 1.74 . . . . 0.0 112.078 -179.458 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 13.3 mt -118.3 138.1 52.61 Favored 'General case' 0 CA--C 1.518 -0.287 0 N-CA-C 103.851 -2.648 . . . . 0.0 103.851 179.292 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 5.5 t -56.4 151.85 12.4 Favored 'General case' 0 CA--C 1.534 0.333 0 N-CA-C 108.968 -0.753 . . . . 0.0 108.968 178.942 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 24.4 t -52.14 -37.1 21.57 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.363 0 N-CA-C 109.106 -0.702 . . . . 0.0 109.106 177.865 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 12.2 m -62.09 -30.46 71.02 Favored 'General case' 0 CA--C 1.541 0.605 0 O-C-N 121.138 -0.976 . . . . 0.0 112.646 179.893 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -81.82 -46.51 14.07 Favored 'General case' 0 CA--C 1.516 -0.356 0 N-CA-C 106.535 -1.654 . . . . 0.0 106.535 177.852 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 82.0 t80 -51.39 -52.68 43.71 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 124.091 0.956 . . . . 0.0 109.327 -179.684 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 13.1 mm -53.0 -64.01 0.43 Allowed 'Isoleucine or valine' 0 C--N 1.34 0.173 0 C-N-CA 126.079 1.752 . . . . 0.0 110.801 179.479 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -54.61 -47.95 72.78 Favored 'General case' 0 C--O 1.22 -0.487 0 CA-C-O 119.133 -0.461 . . . . 0.0 111.305 -178.2 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 11.3 t30 -58.76 -49.79 76.35 Favored 'General case' 0 N--CA 1.445 -0.713 0 C-N-CA 123.455 0.702 . . . . 0.0 112.427 -178.877 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -64.98 -31.97 73.46 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 123.388 0.675 . . . . 0.0 111.146 179.337 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -75.86 -35.65 59.85 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 124.156 0.982 . . . . 0.0 113.05 -179.742 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 22.5 mt -77.54 -44.56 28.18 Favored 'General case' 0 CA--C 1.515 -0.398 0 N-CA-C 113.817 1.043 . . . . 0.0 113.817 -177.81 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 57.9 m-80 . . . . . 0 C--O 1.249 1.047 0 CA-C-O 117.774 -1.108 . . . . 0.0 111.233 179.632 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 1' ' ' SER . . . . . . . . . . . . . 12.8 t . . . . . 0 N--CA 1.466 0.356 0 N-CA-C 104.426 -2.435 . . . . 0.0 104.426 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 2' ' ' ASP . . . . . . . . . . . . . 7.7 p-10 -54.34 -37.77 65.27 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 128.581 2.753 . . . . 0.0 107.76 176.732 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 3' ' ' SER . . . . . . . . . . . . . 22.7 t -145.51 177.36 8.92 Favored 'General case' 0 N--CA 1.435 -1.182 0 C-N-CA 128.745 2.818 . . . . 0.0 105.925 178.874 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 4' ' ' ALA . . . . . . . . . . . . . . . -175.81 88.98 0.04 OUTLIER 'General case' 0 N--CA 1.452 -0.354 0 C-N-CA 126.49 1.916 . . . . 0.0 107.387 179.456 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 12.9 p -57.88 -22.04 17.91 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.66 0 C-N-CA 124.48 1.112 . . . . 0.0 113.388 -179.74 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 6' ' ' ARG . . . . . . . . . . . . . 30.0 ttt180 -63.0 149.31 45.26 Favored 'General case' 0 CA--C 1.536 0.414 0 O-C-N 121.245 -0.909 . . . . 0.0 109.778 179.786 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -139.26 -173.36 3.57 Favored 'General case' 0 C--O 1.237 0.407 0 C-N-CA 124.591 1.156 . . . . 0.0 108.988 179.347 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 46.0 mtmt -133.93 40.74 3.06 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 124.167 0.987 . . . . 0.0 111.39 -178.309 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 1.7 p -68.42 -8.9 44.71 Favored 'General case' 0 CA--C 1.538 0.517 0 N-CA-C 114.302 1.223 . . . . 0.0 114.302 -179.736 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 10' ' ' GLU . . . . . . . . . . . . . 19.1 mp0 -83.8 78.57 9.69 Favored 'General case' 0 N--CA 1.45 -0.445 0 C-N-CA 125.118 1.367 . . . . 0.0 110.231 -177.936 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 11' ' ' VAL . . . . . . . . . . . . . 27.0 m -66.54 -8.16 6.84 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.565 0 C-N-CA 125.111 1.364 . . . . 0.0 113.405 179.869 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 12' ' ' ARG . . . . . . . . . . . . . 4.4 tmm_? -64.47 153.36 39.11 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-N 119.578 1.081 . . . . 0.0 108.462 179.452 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 13' ' ' GLN . . . . . . . . . . . . . 28.4 mm100 -60.05 110.35 1.18 Allowed 'General case' 0 C--O 1.231 0.114 0 N-CA-C 109.532 -0.544 . . . . 0.0 109.532 179.326 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 33.8 pttt -85.61 -27.16 25.64 Favored 'General case' 0 C--N 1.331 -0.209 0 C-N-CA 123.197 0.599 . . . . 0.0 110.033 179.128 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 2.9 t -74.54 -168.96 0.76 Allowed 'General case' 0 N--CA 1.445 -0.713 0 N-CA-C 107.391 -1.337 . . . . 0.0 107.391 178.088 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 2.9 t -141.02 154.54 21.1 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.719 0 N-CA-C 106.432 -1.692 . . . . 0.0 106.432 179.24 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 14.0 p -141.53 114.51 4.37 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.646 0 N-CA-C 106.725 -1.583 . . . . 0.0 106.725 178.579 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 7.9 ttt180 -149.26 148.56 29.71 Favored 'General case' 0 N--CA 1.47 0.553 0 N-CA-C 108.166 -1.05 . . . . 0.0 108.166 178.691 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 2.6 m -101.2 116.66 33.33 Favored 'General case' 0 C--O 1.236 0.376 0 N-CA-C 107.982 -1.118 . . . . 0.0 107.982 -179.614 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -115.28 159.96 20.36 Favored 'General case' 0 C--O 1.235 0.296 0 C-N-CA 124.412 1.085 . . . . 0.0 109.97 -179.508 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 1.5 mtt85 -125.99 162.9 24.19 Favored 'General case' 0 N--CA 1.443 -0.787 0 C-N-CA 124.711 1.204 . . . . 0.0 110.721 178.439 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 22' ' ' PHE . . . . . . . . . . . . . 92.9 m-85 -140.65 146.66 38.18 Favored 'General case' 0 N--CA 1.454 -0.27 0 C-N-CA 124.985 1.314 . . . . 0.0 107.996 179.749 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 14.8 m -73.91 168.75 23.06 Favored Pre-proline 0 CA--C 1.548 0.887 0 N-CA-C 106.714 -1.587 . . . . 0.0 106.714 178.276 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 24' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_endo -63.0 -44.27 16.41 Favored 'Trans proline' 0 N--CA 1.459 -0.523 0 C-N-CA 121.456 1.437 . . . . 0.0 112.825 -178.112 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 25' ' ' VAL . . . . . . . . . . . . . 75.1 t -64.87 -40.22 88.33 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.276 0 C-N-CA 123.894 0.878 . . . . 0.0 110.168 179.609 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 81.9 mt-10 -62.76 -51.05 68.66 Favored 'General case' 0 N--CA 1.453 -0.316 0 N-CA-C 109.494 -0.558 . . . . 0.0 109.494 -179.343 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 27' ' ' ASP . . . . . . . . . . . . . 17.7 t70 -59.28 -47.48 85.2 Favored 'General case' 0 CA--C 1.511 -0.543 0 C-N-CA 125.165 1.386 . . . . 0.0 111.428 179.875 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 28' ' ' GLU . . . . . . . . . . . . . 73.2 tt0 -57.6 -46.91 83.46 Favored 'General case' 0 N--CA 1.447 -0.594 0 C-N-CA 124.589 1.156 . . . . 0.0 109.108 179.421 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 55.9 m -61.82 -57.86 10.22 Favored 'General case' 0 CA--C 1.533 0.323 0 N-CA-C 109.618 -0.512 . . . . 0.0 109.618 179.067 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 90.2 mt -53.92 -46.13 64.19 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.1 0 C-N-CA 123.539 0.736 . . . . 0.0 110.671 -178.066 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 63.0 ttt180 -61.14 -47.92 83.98 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-O 118.688 -0.672 . . . . 0.0 110.72 -179.665 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -65.24 -46.32 81.04 Favored 'General case' 0 CA--C 1.517 -0.302 0 CA-C-O 118.617 -0.706 . . . . 0.0 110.214 -179.073 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 65.1 mttt -59.22 -47.82 83.93 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-N 118.935 0.789 . . . . 0.0 110.276 -179.497 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 34' ' ' ALA . . . . . . . . . . . . . . . -57.86 -56.45 21.82 Favored 'General case' 0 N--CA 1.45 -0.457 0 C-N-CA 124.229 1.011 . . . . 0.0 110.248 179.802 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 17.4 tt0 -62.94 -34.6 77.82 Favored 'General case' 0 C--N 1.33 -0.253 0 C-N-CA 123.796 0.839 . . . . 0.0 112.783 -177.681 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 36' ' ' ASP . . . . . . . . . . . . . 5.3 t70 -67.94 -42.36 81.12 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 108.263 -1.014 . . . . 0.0 108.263 178.715 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 37' ' ' SER . . . . . . . . . . . . . 31.8 t -71.98 -27.0 62.47 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-O 121.244 0.545 . . . . 0.0 109.861 179.412 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 97.72 -4.05 61.26 Favored Glycine 0 CA--C 1.523 0.541 0 C-N-CA 125.203 1.382 . . . . 0.0 111.877 -179.712 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 39' ' ' LEU . . . . . . . . . . . . . 31.8 mt -87.85 144.29 26.67 Favored 'General case' 0 N--CA 1.438 -1.038 0 C-N-CA 125.255 1.422 . . . . 0.0 107.168 -179.959 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 40' ' ' THR . . . . . . . . . . . . . 1.8 t -68.39 147.25 52.35 Favored 'General case' 0 C--N 1.313 -0.988 0 N-CA-C 106.039 -1.837 . . . . 0.0 106.039 177.56 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 41' ' ' VAL . . . . . . . . . . . . . 53.7 t -49.88 -38.26 13.77 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.446 0 O-C-N 121.524 -0.735 . . . . 0.0 110.926 179.144 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 42' ' ' SER . . . . . . . . . . . . . 14.1 p -61.67 -37.78 85.33 Favored 'General case' 0 CA--C 1.533 0.327 0 O-C-N 121.071 -1.018 . . . . 0.0 111.836 179.651 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -73.73 -43.3 59.54 Favored 'General case' 0 C--N 1.341 0.211 0 C-N-CA 125.802 1.641 . . . . 0.0 108.3 178.492 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 44' ' ' TYR . . . . . . . . . . . . . 47.2 t80 -56.08 -50.01 72.2 Favored 'General case' 0 N--CA 1.451 -0.378 0 C-N-CA 123.721 0.809 . . . . 0.0 109.323 179.489 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 45' ' ' ILE . . . . . . . . . . . . . 12.8 mm -52.56 -63.93 0.43 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.291 0 C-N-CA 124.786 1.235 . . . . 0.0 110.727 179.765 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 46' ' ' ARG . . . . . . . . . . . . . 15.2 ptp180 -55.36 -48.06 74.83 Favored 'General case' 0 C--O 1.226 -0.161 0 C-N-CA 123.602 0.761 . . . . 0.0 112.081 -179.5 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 47' ' ' ASN . . . . . . . . . . . . . 29.9 t30 -59.42 -53.17 61.19 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-O 118.717 -0.659 . . . . 0.0 111.141 -179.347 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -63.28 -32.76 74.26 Favored 'General case' 0 C--O 1.224 -0.24 0 C-N-CA 123.753 0.821 . . . . 0.0 112.283 -179.574 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 49' ' ' ALA . . . . . . . . . . . . . . . -68.62 -37.03 79.42 Favored 'General case' 0 C--O 1.232 0.167 0 O-C-N 121.758 -0.589 . . . . 0.0 111.145 179.931 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 21.4 mt -79.8 -41.36 26.62 Favored 'General case' 0 CA--C 1.521 -0.147 0 CA-C-O 119.1 -0.476 . . . . 0.0 110.439 -179.687 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 51' ' ' ASN . . . . . . . . . . . . . 57.5 m-80 . . . . . 0 C--O 1.253 1.286 0 C-N-CA 124.335 1.054 . . . . 0.0 111.295 -178.492 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 32.6 m . . . . . 0 N--CA 1.482 1.163 0 N-CA-C 104.464 -2.421 . . . . 0.0 104.464 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -124.86 -13.65 6.86 Favored 'General case' 0 C--N 1.321 -0.644 0 C-N-CA 127.865 2.466 . . . . 0.0 113.045 -172.701 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 26.5 t -73.19 117.81 15.38 Favored 'General case' 0 CA--C 1.532 0.251 0 N-CA-C 108.509 -0.923 . . . . 0.0 108.509 179.157 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -97.87 -13.1 21.44 Favored 'General case' 0 CA--C 1.536 0.441 0 N-CA-C 113.33 0.863 . . . . 0.0 113.33 -179.926 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 2.6 t 37.38 44.53 0.25 Allowed 'Isoleucine or valine' 0 CA--C 1.547 0.861 0 C-N-CA 128.138 2.575 . . . . 0.0 112.9 -179.733 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 9.6 mmp_? -68.54 132.49 47.04 Favored 'General case' 0 C--O 1.234 0.26 0 N-CA-C 107.206 -1.405 . . . . 0.0 107.206 179.889 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 38.4 tttm -141.51 -18.94 0.77 Allowed 'General case' 0 N--CA 1.465 0.318 0 C-N-CA 123.611 0.765 . . . . 0.0 112.455 179.936 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 35.7 pttt -157.83 86.14 0.91 Allowed 'General case' 0 C--N 1.332 -0.187 0 N-CA-C 106.296 -1.742 . . . . 0.0 106.296 179.296 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 18.5 m -53.57 -45.27 69.88 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 123.479 0.712 . . . . 0.0 109.484 -179.765 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 37.6 mt-10 -153.87 160.17 42.06 Favored 'General case' 0 N--CA 1.452 -0.351 0 C-N-CA 126.115 1.766 . . . . 0.0 107.189 178.782 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 2.7 t -144.98 103.82 0.69 Allowed 'Isoleucine or valine' 0 N--CA 1.457 -0.089 0 N-CA-C 105.714 -1.958 . . . . 0.0 105.714 178.635 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 47.4 mtp180 -52.26 -52.62 51.56 Favored 'General case' 0 N--CA 1.467 0.395 0 C-N-CA 124.113 0.965 . . . . 0.0 109.085 -179.578 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 14.4 pt20 -120.28 85.24 2.35 Favored 'General case' 0 N--CA 1.447 -0.594 0 C-N-CA 126.215 1.806 . . . . 0.0 108.003 179.74 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 21.5 ptmt -65.48 -35.79 81.94 Favored 'General case' 0 C--O 1.222 -0.372 0 CA-C-N 115.588 -0.733 . . . . 0.0 111.382 179.457 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 4.0 t -81.59 167.29 19.41 Favored 'General case' 0 N--CA 1.446 -0.637 0 C-N-CA 123.97 0.908 . . . . 0.0 108.883 178.778 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 2.4 t -119.05 156.48 21.12 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 C-N-CA 125.954 1.701 . . . . 0.0 106.623 178.485 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 14.8 p -144.47 123.47 6.72 Favored 'Isoleucine or valine' 0 C--O 1.238 0.499 0 N-CA-C 106.73 -1.582 . . . . 0.0 106.73 178.928 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 13.7 ttm180 -154.51 164.92 37.95 Favored 'General case' 0 C--O 1.234 0.266 0 O-C-N 121.674 -0.641 . . . . 0.0 109.516 179.416 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 3.8 m -107.84 135.32 49.44 Favored 'General case' 0 N--CA 1.448 -0.542 0 N-CA-C 105.327 -2.101 . . . . 0.0 105.327 178.721 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 43.9 mt -129.91 108.76 10.37 Favored 'General case' 0 CA--C 1.512 -0.513 0 N-CA-C 108.584 -0.895 . . . . 0.0 108.584 179.293 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -77.86 150.32 34.19 Favored 'General case' 0 N--CA 1.45 -0.462 0 N-CA-C 107.213 -1.403 . . . . 0.0 107.213 177.555 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 66.6 m-85 -144.02 161.74 38.0 Favored 'General case' 0 C--O 1.237 0.433 0 N-CA-C 106.508 -1.664 . . . . 0.0 106.508 178.185 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 36.7 m -92.71 167.6 14.21 Favored Pre-proline 0 CA--C 1.538 0.483 0 C-N-CA 124.58 1.152 . . . . 0.0 109.407 179.453 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -63.01 -29.81 75.82 Favored 'Trans proline' 0 C--N 1.347 0.45 0 C-N-CA 122.861 2.374 . . . . 0.0 113.306 -178.808 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 71.6 t -68.63 -54.61 19.99 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.455 0 N-CA-C 107.381 -1.34 . . . . 0.0 107.381 179.134 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 28.0 mt-10 -59.45 -44.08 93.04 Favored 'General case' 0 C--O 1.223 -0.302 0 C-N-CA 125.231 1.412 . . . . 0.0 110.58 179.964 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -62.13 -48.54 79.69 Favored 'General case' 0 CA--C 1.512 -0.489 0 C-N-CA 125.667 1.587 . . . . 0.0 110.919 179.984 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 76.7 tt0 -59.69 -42.4 92.89 Favored 'General case' 0 N--CA 1.453 -0.284 0 N-CA-C 108.509 -0.923 . . . . 0.0 108.509 178.486 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 18.8 m -62.26 -60.31 3.77 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 123.461 0.704 . . . . 0.0 109.559 -179.932 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 96.5 mt -57.87 -39.54 71.83 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.163 0 C-N-CA 124.195 0.998 . . . . 0.0 111.064 -178.965 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 19.8 ttt180 -69.36 -37.11 77.46 Favored 'General case' 0 C--N 1.332 -0.186 0 O-C-N 120.907 -1.12 . . . . 0.0 110.675 -179.81 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 2.2 mptp? -70.15 -49.24 52.55 Favored 'General case' 0 CA--C 1.517 -0.29 0 N-CA-C 109.385 -0.598 . . . . 0.0 109.385 178.973 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 3.2 mptp? -63.81 -46.48 84.97 Favored 'General case' 0 CA--C 1.511 -0.521 0 C-N-CA 124.478 1.111 . . . . 0.0 110.682 -178.462 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -59.27 -53.96 52.3 Favored 'General case' 0 N--CA 1.452 -0.368 0 CA-C-N 119.137 0.881 . . . . 0.0 109.794 179.611 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 41.9 tt0 -62.45 -38.06 88.3 Favored 'General case' 0 CA--C 1.532 0.282 0 N-CA-C 112.011 0.374 . . . . 0.0 112.011 -178.099 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 31.6 t70 -69.64 -37.95 76.97 Favored 'General case' 0 C--O 1.233 0.228 0 C-N-CA 123.535 0.734 . . . . 0.0 109.878 179.194 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 10.4 t -72.37 -8.04 52.84 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 124.224 1.01 . . . . 0.0 108.639 177.802 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 71.03 6.72 60.99 Favored Glycine 0 C--N 1.341 0.86 0 C-N-CA 126.098 1.808 . . . . 0.0 113.108 -179.488 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 15.3 mt -101.66 161.05 13.93 Favored 'General case' 0 N--CA 1.441 -0.888 0 C-N-CA 126.161 1.784 . . . . 0.0 107.127 -179.491 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' THR . . . . . 0.441 HG21 ' H ' ' A' ' 43' ' ' ALA . 5.1 t -81.04 155.16 26.48 Favored 'General case' 0 C--N 1.313 -1.012 0 O-C-N 120.42 -1.425 . . . . 0.0 107.641 178.781 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 20.8 t -51.65 -39.75 24.41 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.407 0 C-N-CA 124.87 1.268 . . . . 0.0 110.099 178.659 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 15.2 p -61.44 -50.46 72.7 Favored 'General case' 0 CA--C 1.534 0.35 0 O-C-N 121.907 -0.496 . . . . 0.0 109.987 179.303 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . 0.441 ' H ' HG21 ' A' ' 40' ' ' THR . . . -59.86 -48.84 80.05 Favored 'General case' 0 CA--C 1.519 -0.217 0 C-N-CA 125.737 1.615 . . . . 0.0 109.959 178.997 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 81.9 t80 -51.14 -49.56 60.61 Favored 'General case' 0 N--CA 1.45 -0.47 0 C-N-CA 124.814 1.246 . . . . 0.0 109.803 -179.873 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 13.9 mm -57.67 -65.01 0.46 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.394 0 C-N-CA 124.067 0.947 . . . . 0.0 110.62 179.373 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 7.2 ptp180 -53.81 -41.65 67.54 Favored 'General case' 0 C--N 1.341 0.198 0 CA-C-O 117.886 -1.054 . . . . 0.0 111.906 -178.424 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 28.9 t30 -61.88 -55.89 25.02 Favored 'General case' 0 N--CA 1.453 -0.312 0 C-N-CA 124.014 0.926 . . . . 0.0 110.127 179.68 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -61.5 -29.55 70.05 Favored 'General case' 0 C--O 1.224 -0.248 0 C-N-CA 123.176 0.59 . . . . 0.0 112.288 -179.133 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -77.6 -26.38 50.62 Favored 'General case' 0 N--CA 1.451 -0.412 0 N-CA-C 113.148 0.796 . . . . 0.0 113.148 179.885 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 18.5 mt -88.92 -42.69 11.67 Favored 'General case' 0 CA--C 1.514 -0.413 0 O-C-N 121.031 -1.043 . . . . 0.0 109.346 -179.679 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 5.5 m-80 . . . . . 0 C--O 1.242 0.683 0 O-C-N 124.628 1.205 . . . . 0.0 107.883 179.461 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 1' ' ' SER . . . . . . . . . . . . . 30.2 m . . . . . 0 N--CA 1.482 1.132 0 N-CA-C 103.708 -2.701 . . . . 0.0 103.708 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 2' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -127.16 -11.96 5.8 Favored 'General case' 0 N--CA 1.447 -0.596 0 CA-C-N 112.915 -1.948 . . . . 0.0 114.144 -172.08 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 3' ' ' SER . . . . . . . . . . . . . 19.0 t -71.41 118.35 14.11 Favored 'General case' 0 N--CA 1.453 -0.296 0 N-CA-C 106.712 -1.588 . . . . 0.0 106.712 178.903 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 4' ' ' ALA . . . . . . . . . . . . . . . -71.44 -15.39 62.34 Favored 'General case' 0 CA--C 1.537 0.479 0 N-CA-C 113.327 0.862 . . . . 0.0 113.327 -179.778 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 3.5 t 43.25 48.35 0.37 Allowed 'Isoleucine or valine' 0 CA--C 1.546 0.824 0 C-N-CA 126.994 2.118 . . . . 0.0 112.319 -179.326 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 6' ' ' ARG . . . . . . . . . . . . . 15.6 mmp_? -98.92 148.85 23.54 Favored 'General case' 0 N--CA 1.464 0.229 0 O-C-N 120.351 -1.468 . . . . 0.0 107.319 178.613 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 36.5 tttm -154.12 -34.32 0.1 Allowed 'General case' 0 N--CA 1.465 0.32 0 C-N-CA 123.957 0.903 . . . . 0.0 111.868 -179.63 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 95.6 mttt -141.5 94.2 2.66 Favored 'General case' 0 N--CA 1.457 -0.093 0 N-CA-C 103.237 -2.875 . . . . 0.0 103.237 179.102 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 6.4 m -57.85 -58.74 7.04 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 119.34 0.973 . . . . 0.0 108.4 -179.439 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 10' ' ' GLU . . . . . . . . . . . . . 5.1 pm0 -137.54 162.25 34.24 Favored 'General case' 0 N--CA 1.452 -0.35 0 C-N-CA 125.301 1.44 . . . . 0.0 107.937 179.084 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 11' ' ' VAL . . . . . . . . . . . . . 68.6 t -146.11 123.57 4.15 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.337 0 N-CA-C 108.093 -1.077 . . . . 0.0 108.093 -179.948 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 12' ' ' ARG . . . . . . . . . . . . . 17.5 mtp180 -67.92 -57.69 5.79 Favored 'General case' 0 N--CA 1.468 0.43 0 C-N-CA 123.804 0.842 . . . . 0.0 110.234 -179.741 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 13' ' ' GLN . . . . . . . . . . . . . 72.4 mt-30 -120.3 90.44 3.33 Favored 'General case' 0 C--O 1.235 0.319 0 C-N-CA 125.453 1.501 . . . . 0.0 107.179 -179.528 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 17.5 ptmt -66.54 -33.29 75.36 Favored 'General case' 0 C--N 1.333 -0.138 0 C-N-CA 123.567 0.747 . . . . 0.0 111.159 179.683 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 1.3 t -74.48 176.08 7.16 Favored 'General case' 0 N--CA 1.443 -0.784 0 CA-C-O 122.152 0.977 . . . . 0.0 110.923 -179.768 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 41.0 t -117.76 146.66 21.94 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 C-N-CA 126.813 2.045 . . . . 0.0 105.902 179.02 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 7.2 p -146.07 107.76 0.77 Allowed 'Isoleucine or valine' 0 N--CA 1.451 -0.418 0 N-CA-C 105.343 -2.095 . . . . 0.0 105.343 178.326 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 9.8 ttt180 -149.52 166.43 29.21 Favored 'General case' 0 CA--C 1.509 -0.633 0 N-CA-C 109.978 -0.378 . . . . 0.0 109.978 -179.739 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 19.2 m -105.49 145.7 30.54 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 108.282 -1.007 . . . . 0.0 108.282 179.699 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 26.7 mt -135.5 143.5 45.84 Favored 'General case' 0 N--CA 1.443 -0.816 0 N-CA-C 106.481 -1.674 . . . . 0.0 106.481 177.405 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -114.91 143.2 45.52 Favored 'General case' 0 N--CA 1.448 -0.526 0 N-CA-C 105.434 -2.061 . . . . 0.0 105.434 178.976 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 22' ' ' PHE . . . . . . . . . . . . . 95.8 m-85 -136.46 140.98 43.5 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 106.145 -1.798 . . . . 0.0 106.145 179.632 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 4.6 m -74.87 169.08 21.76 Favored Pre-proline 0 CA--C 1.543 0.699 0 C-N-CA 123.33 0.652 . . . . 0.0 109.272 179.802 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 24' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo -67.06 -28.92 40.85 Favored 'Trans proline' 0 C--N 1.348 0.525 0 C-N-CA 122.025 1.817 . . . . 0.0 113.573 -178.294 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 25' ' ' VAL . . . . . . . . . . . . . 46.8 t -74.51 -48.34 35.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 N-CA-C 107.38 -1.341 . . . . 0.0 107.38 -179.666 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 26.8 mp0 -59.51 -43.28 93.42 Favored 'General case' 0 N--CA 1.448 -0.566 0 C-N-CA 125.071 1.348 . . . . 0.0 109.206 179.181 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 27' ' ' ASP . . . . . . . . . . . . . 19.3 t70 -63.65 -50.27 69.96 Favored 'General case' 0 C--O 1.224 -0.246 0 C-N-CA 124.252 1.021 . . . . 0.0 109.84 179.136 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 28' ' ' GLU . . . . . . . . . . . . . 64.1 tt0 -60.89 -17.21 49.33 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 125.138 1.375 . . . . 0.0 110.915 179.254 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 27.2 m -91.92 -61.44 1.63 Allowed 'General case' 0 N--CA 1.453 -0.317 0 N-CA-C 107.671 -1.233 . . . . 0.0 107.671 178.427 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 96.4 mt -58.17 -29.34 36.86 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.484 0 C-N-CA 124.109 0.964 . . . . 0.0 112.462 -178.388 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 61.8 ttt180 -73.58 -32.19 64.0 Favored 'General case' 0 C--N 1.328 -0.355 0 O-C-N 120.358 -1.464 . . . . 0.0 110.185 -179.959 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 3.7 mptp? -81.03 -50.51 9.58 Favored 'General case' 0 N--CA 1.456 -0.135 0 C-N-CA 123.584 0.754 . . . . 0.0 112.274 -179.475 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 4.6 mptp? -61.15 -42.06 97.88 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-O 118.95 -0.547 . . . . 0.0 110.785 -177.847 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 34' ' ' ALA . . . . . . . . . . . . . . . -60.1 -54.55 44.56 Favored 'General case' 0 N--CA 1.455 -0.213 0 C-N-CA 124.155 0.982 . . . . 0.0 108.794 179.614 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 16.4 tt0 -61.14 -36.38 79.63 Favored 'General case' 0 CA--C 1.532 0.273 0 N-CA-C 112.435 0.532 . . . . 0.0 112.435 -178.522 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 36' ' ' ASP . . . . . . . . . . . . . 5.8 t70 -70.85 -34.16 71.37 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 124.095 0.958 . . . . 0.0 110.279 178.88 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 37' ' ' SER . . . . . . . . . . . . . 9.6 t -79.69 -6.0 56.32 Favored 'General case' 0 N--CA 1.453 -0.309 0 C-N-CA 124.207 1.003 . . . . 0.0 111.906 179.388 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 68.03 20.55 72.9 Favored Glycine 0 CA--C 1.534 1.237 0 N-CA-C 110.642 -0.983 . . . . 0.0 110.642 -178.299 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 39' ' ' LEU . . . . . . . . . . . . . 55.4 mt -115.61 128.84 56.23 Favored 'General case' 0 CA--C 1.514 -0.413 0 N-CA-C 104.994 -2.224 . . . . 0.0 104.994 179.943 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 40' ' ' THR . . . . . . . . . . . . . 1.2 t -63.38 152.9 36.81 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 107.659 -1.237 . . . . 0.0 107.659 178.987 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 41' ' ' VAL . . . . . . . . . . . . . 40.2 t -47.64 -40.8 7.73 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.638 0 C-N-CA 124.454 1.102 . . . . 0.0 110.455 178.366 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 42' ' ' SER . . . . . . . . . . . . . 9.8 m -63.35 -36.62 84.3 Favored 'General case' 0 CA--C 1.546 0.791 0 O-C-N 119.827 -1.795 . . . . 0.0 111.667 179.809 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -74.82 -45.57 42.52 Favored 'General case' 0 C--O 1.223 -0.294 0 C-N-CA 125.612 1.565 . . . . 0.0 110.687 178.766 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 44' ' ' TYR . . . . . . . . . . . . . 4.1 t80 -55.89 -41.07 73.91 Favored 'General case' 0 CA--C 1.537 0.444 0 CA-C-N 119.158 0.89 . . . . 0.0 109.42 179.527 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 45' ' ' ILE . . . . . . . . . . . . . 13.2 mm -57.63 -64.31 0.55 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.37 0 CA-C-N 118.847 0.749 . . . . 0.0 109.763 178.897 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 46' ' ' ARG . . . . . . . . . . . . . 12.8 ptp180 -56.0 -46.53 78.71 Favored 'General case' 0 C--O 1.219 -0.508 0 CA-C-O 118.257 -0.878 . . . . 0.0 111.368 -179.15 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 47' ' ' ASN . . . . . . . . . . . . . 35.3 t30 -54.69 -54.43 41.92 Favored 'General case' 0 N--CA 1.452 -0.33 0 CA-C-N 118.989 0.813 . . . . 0.0 110.678 -179.557 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -64.13 -29.58 70.69 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 123.82 0.848 . . . . 0.0 112.35 -179.955 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 49' ' ' ALA . . . . . . . . . . . . . . . -78.75 -14.82 59.07 Favored 'General case' 0 CA--C 1.53 0.186 0 C-N-CA 124.372 1.069 . . . . 0.0 113.277 -179.557 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 11.8 mt -112.83 -35.4 5.48 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-N 119.241 0.928 . . . . 0.0 113.15 -179.264 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 51' ' ' ASN . . . . . . . . . . . . . 70.3 m-80 . . . . . 0 CA--C 1.5 -0.978 0 CA-C-O 116.339 -1.791 . . . . 0.0 112.279 -177.503 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 14.9 m . . . . . 0 N--CA 1.47 0.575 0 CA-C-O 120.586 0.231 . . . . 0.0 110.692 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 9.5 t0 -138.35 -172.34 3.26 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 127.033 2.133 . . . . 0.0 107.908 179.511 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 75.1 m -128.49 170.83 12.7 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-N 120.675 1.579 . . . . 0.0 110.99 179.469 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -74.18 -14.85 61.01 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 123.859 0.864 . . . . 0.0 112.125 179.517 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 12.5 m -130.67 121.27 50.03 Favored 'Isoleucine or valine' 0 C--O 1.234 0.284 0 N-CA-C 105.351 -2.092 . . . . 0.0 105.351 178.84 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 11.5 tpt180 -85.2 -55.25 4.13 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-O 118.644 -0.693 . . . . 0.0 110.464 -179.317 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 41.0 pttt 29.98 57.76 0.18 Allowed 'General case' 0 N--CA 1.466 0.374 0 C-N-CA 128.67 2.788 . . . . 0.0 111.681 -178.713 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 13.3 tptm -118.69 108.79 15.33 Favored 'General case' 0 CA--C 1.515 -0.384 0 N-CA-C 104.826 -2.287 . . . . 0.0 104.826 -179.601 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 5.8 p -120.61 173.7 7.03 Favored 'General case' 0 C--N 1.322 -0.597 0 C-N-CA 125.854 1.662 . . . . 0.0 110.99 -177.988 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 27.2 tt0 -76.14 132.18 39.85 Favored 'General case' 0 CA--C 1.535 0.387 0 N-CA-C 104.58 -2.378 . . . . 0.0 104.58 177.911 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 2.5 t -46.25 -41.84 4.55 Favored 'Isoleucine or valine' 0 C--O 1.237 0.437 0 C-N-CA 124.911 1.285 . . . . 0.0 113.357 -177.96 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 21.3 tpp180 -116.01 114.6 24.81 Favored 'General case' 0 C--O 1.235 0.315 0 N-CA-C 106.357 -1.72 . . . . 0.0 106.357 179.466 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 15.7 tt0 -81.16 86.18 6.23 Favored 'General case' 0 CA--C 1.527 0.09 0 N-CA-C 103.932 -2.618 . . . . 0.0 103.932 178.228 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 20.0 ptmt -60.61 -25.97 66.65 Favored 'General case' 0 C--O 1.225 -0.223 0 C-N-CA 123.611 0.764 . . . . 0.0 112.124 -179.101 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 5.8 t -90.0 159.63 16.78 Favored 'General case' 0 N--CA 1.444 -0.754 0 CA-C-O 122.323 1.059 . . . . 0.0 108.803 179.262 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 20.3 t -96.57 145.39 8.85 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.621 0 N-CA-C 104.603 -2.369 . . . . 0.0 104.603 178.062 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 8.0 p -143.38 107.45 1.23 Allowed 'Isoleucine or valine' 0 C--O 1.238 0.485 0 N-CA-C 104.909 -2.256 . . . . 0.0 104.909 178.295 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 10.0 ttt85 -141.94 162.14 36.21 Favored 'General case' 0 C--O 1.237 0.411 0 CA-C-O 121.423 0.63 . . . . 0.0 111.826 -179.251 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 42.0 m -92.12 103.43 15.92 Favored 'General case' 0 N--CA 1.445 -0.7 0 N-CA-C 105.144 -2.169 . . . . 0.0 105.144 179.503 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 18.6 tp -110.58 111.64 22.99 Favored 'General case' 0 C--N 1.323 -0.553 0 C-N-CA 123.931 0.893 . . . . 0.0 108.75 179.836 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 11.5 mmm-85 -94.51 150.96 19.73 Favored 'General case' 0 N--CA 1.451 -0.38 0 C-N-CA 124.637 1.175 . . . . 0.0 109.879 179.785 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 87.2 m-85 -128.82 179.09 5.91 Favored 'General case' 0 C--O 1.237 0.412 0 C-N-CA 125.853 1.661 . . . . 0.0 108.096 178.457 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 62.6 m -112.06 173.94 2.59 Favored Pre-proline 0 CA--C 1.543 0.687 0 CA-C-O 117.563 -1.208 . . . . 0.0 109.041 179.853 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 45.1 Cg_endo -68.51 -48.9 0.96 Allowed 'Trans proline' 0 C--N 1.35 0.617 0 CA-C-N 121.557 1.592 . . . . 0.0 113.478 -177.15 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 20.4 t -66.17 -37.2 79.21 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.432 0 N-CA-C 109.657 -0.498 . . . . 0.0 109.657 -179.499 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 49.8 mt-10 -64.62 -50.86 65.49 Favored 'General case' 0 C--N 1.341 0.212 0 N-CA-C 108.788 -0.819 . . . . 0.0 108.788 179.636 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 6.0 t70 -57.52 -45.34 85.11 Favored 'General case' 0 CA--C 1.513 -0.463 0 C-N-CA 124.972 1.309 . . . . 0.0 110.617 179.642 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -60.51 -46.19 91.06 Favored 'General case' 0 N--CA 1.45 -0.437 0 C-N-CA 123.296 0.638 . . . . 0.0 109.438 179.703 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 27.8 m -60.7 -57.08 14.2 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 123.179 0.592 . . . . 0.0 109.94 179.671 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 40.5 mt -58.03 -43.13 84.43 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.317 0 C-N-CA 124.927 1.291 . . . . 0.0 110.992 -178.815 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 43.5 ttt180 -62.29 -48.2 80.92 Favored 'General case' 0 CA--C 1.516 -0.363 0 C-N-CA 123.359 0.663 . . . . 0.0 110.499 -179.604 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -63.91 -46.11 86.27 Favored 'General case' 0 CA--C 1.518 -0.251 0 C-N-CA 120.659 -0.416 . . . . 0.0 110.09 -178.842 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 8.2 tptm -63.7 -44.63 93.07 Favored 'General case' 0 N--CA 1.455 -0.181 0 CA-C-O 119.615 -0.231 . . . . 0.0 110.993 -179.349 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -59.93 -51.64 68.82 Favored 'General case' 0 N--CA 1.454 -0.254 0 C-N-CA 124.041 0.936 . . . . 0.0 110.579 179.754 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 39.2 tt0 -64.65 -36.66 84.96 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-O 119.113 -0.47 . . . . 0.0 110.829 -179.053 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 27.5 t70 -67.69 -43.98 78.82 Favored 'General case' 0 CA--C 1.518 -0.267 0 C-N-CA 123.954 0.902 . . . . 0.0 109.802 179.147 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 31.2 t -73.23 -14.79 61.4 Favored 'General case' 0 CA--C 1.542 0.663 0 CA-C-O 122.105 0.955 . . . . 0.0 109.645 179.025 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 77.88 8.73 87.26 Favored Glycine 0 N--CA 1.443 -0.894 0 O-C-N 120.542 -1.349 . . . . 0.0 114.829 178.902 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 15.0 mt -114.41 118.36 33.62 Favored 'General case' 0 CA--C 1.515 -0.403 0 N-CA-C 103.742 -2.688 . . . . 0.0 103.742 179.252 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 12.7 t -48.13 158.75 0.23 Allowed 'General case' 0 C--N 1.329 -0.3 0 C-N-CA 124.811 1.244 . . . . 0.0 111.569 -179.292 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 69.7 t -46.06 -44.29 5.23 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.342 0 C-N-CA 125.038 1.335 . . . . 0.0 112.02 -178.885 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 11.8 p -62.72 -41.62 99.25 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-N 120.498 1.499 . . . . 0.0 111.848 -179.994 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -67.71 -49.98 59.87 Favored 'General case' 0 C--O 1.218 -0.569 0 N-CA-C 108.106 -1.072 . . . . 0.0 108.106 178.222 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 45.8 t80 -52.22 -51.38 58.59 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 123.963 0.905 . . . . 0.0 108.647 179.28 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 6.2 mm -55.61 -62.62 0.76 Allowed 'Isoleucine or valine' 0 C--O 1.225 -0.194 0 C-N-CA 125.704 1.602 . . . . 0.0 110.744 179.608 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 21.4 ptt180 -59.13 -45.7 90.24 Favored 'General case' 0 C--O 1.222 -0.343 0 CA-C-O 119.07 -0.491 . . . . 0.0 111.626 -178.162 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 21.7 t30 -58.25 -52.43 65.59 Favored 'General case' 0 N--CA 1.45 -0.464 0 C-N-CA 124.222 1.009 . . . . 0.0 111.099 -178.905 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -67.97 -25.62 65.53 Favored 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 124.333 1.053 . . . . 0.0 112.148 179.736 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -80.71 -41.97 22.72 Favored 'General case' 0 N--CA 1.454 -0.261 0 CA-C-N 118.428 0.558 . . . . 0.0 111.444 179.699 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 27.9 mt -73.2 -45.11 58.16 Favored 'General case' 0 CA--C 1.516 -0.355 0 C-N-CA 123.561 0.745 . . . . 0.0 111.809 -178.96 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 68.2 m-80 . . . . . 0 C--O 1.251 1.14 0 CA-C-O 116.961 -1.495 . . . . 0.0 111.136 -178.421 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 1' ' ' SER . . . . . . . . . . . . . 10.0 m . . . . . 0 N--CA 1.466 0.353 0 N-CA-C 108.906 -0.776 . . . . 0.0 108.906 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 2' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -121.44 159.63 25.83 Favored 'General case' 0 CA--C 1.514 -0.43 0 CA-C-O 122.187 0.994 . . . . 0.0 110.415 -179.434 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 3' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -92.17 174.31 7.37 Favored 'General case' 0 N--CA 1.443 -0.809 0 C-N-CA 126.834 2.053 . . . . 0.0 107.884 179.062 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 4' ' ' ALA . . . . . . . . . . . . . . . -70.9 -0.56 9.45 Favored 'General case' 0 CA--C 1.545 0.779 0 O-C-N 121.786 -0.571 . . . . 0.0 111.075 178.132 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 35.7 m -141.12 169.69 14.59 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.485 0 C-N-CA 128.014 2.526 . . . . 0.0 108.221 179.63 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 6' ' ' ARG . . . . . . . . . . . . . 11.0 tpt180 -133.39 -59.6 0.86 Allowed 'General case' 0 N--CA 1.462 0.142 0 C-N-CA 124.933 1.293 . . . . 0.0 111.178 -179.363 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 43.9 pttt 35.22 72.58 0.1 Allowed 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 126.975 2.11 . . . . 0.0 113.579 -179.856 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 20.0 tptm -117.81 93.2 4.06 Favored 'General case' 0 N--CA 1.465 0.294 0 O-C-N 121.452 -0.78 . . . . 0.0 111.324 -179.297 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 10.0 p -85.87 -178.1 6.51 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 127.14 2.176 . . . . 0.0 110.133 179.284 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 10' ' ' GLU . . . . . . . . . . . . . 10.1 tt0 -96.52 156.98 16.11 Favored 'General case' 0 CA--C 1.537 0.47 0 N-CA-C 107.613 -1.254 . . . . 0.0 107.613 178.037 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 11' ' ' VAL . . . . . . . . . . . . . 82.0 t -60.48 -67.69 0.29 Allowed 'Isoleucine or valine' 0 C--O 1.237 0.428 0 C-N-CA 124.729 1.211 . . . . 0.0 111.481 -179.078 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 12' ' ' ARG . . . . . . . . . . . . . 7.7 tpp85 -106.67 102.42 11.8 Favored 'General case' 0 CA--C 1.516 -0.35 0 N-CA-C 106.48 -1.674 . . . . 0.0 106.48 179.817 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 13' ' ' GLN . . . . . . . . . . . . . 5.1 tt0 -66.39 103.2 0.98 Allowed 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 106.927 -1.508 . . . . 0.0 106.927 179.3 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 8.2 ptmt -73.32 -23.65 60.28 Favored 'General case' 0 N--CA 1.467 0.383 0 C-N-CA 126.384 1.874 . . . . 0.0 114.925 -178.588 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 13.1 t -81.72 -169.06 2.15 Favored 'General case' 0 N--CA 1.443 -0.822 0 C-N-CA 126.257 1.823 . . . . 0.0 111.428 -178.425 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 2.6 t -143.73 91.22 0.41 Allowed 'Isoleucine or valine' 0 N--CA 1.441 -0.915 0 N-CA-C 103.757 -2.682 . . . . 0.0 103.757 178.378 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 8.1 p -92.27 118.6 38.15 Favored 'Isoleucine or valine' 0 C--O 1.239 0.528 0 N-CA-C 104.332 -2.47 . . . . 0.0 104.332 178.459 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 13.1 ttt85 -145.58 176.57 9.52 Favored 'General case' 0 C--O 1.233 0.229 0 O-C-N 121.432 -0.792 . . . . 0.0 109.732 -178.783 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 25.7 m -114.98 90.19 3.28 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 105.487 -2.042 . . . . 0.0 105.487 -179.546 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -95.06 106.12 18.09 Favored 'General case' 0 C--N 1.324 -0.533 0 C-N-CA 124.474 1.11 . . . . 0.0 108.176 -179.126 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 12.0 mtm180 -91.52 155.9 18.07 Favored 'General case' 0 C--O 1.238 0.467 0 CA-C-N 118.342 0.519 . . . . 0.0 111.357 178.892 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 22' ' ' PHE . . . . . . . . . . . . . 96.8 m-85 -136.44 143.97 44.17 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 107.801 -1.185 . . . . 0.0 107.801 179.796 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -75.21 168.17 30.07 Favored Pre-proline 0 CA--C 1.543 0.694 0 C-N-CA 123.555 0.742 . . . . 0.0 109.888 179.45 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 24' ' ' PRO . . . . . . . . . . . . . 34.2 Cg_endo -61.35 -40.83 45.91 Favored 'Trans proline' 0 C--N 1.348 0.541 0 C-N-CA 122.808 2.338 . . . . 0.0 113.283 -177.921 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 25' ' ' VAL . . . . . . . . . . . . . 38.5 t -72.15 -33.57 47.16 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.491 0 N-CA-C 109.271 -0.64 . . . . 0.0 109.271 179.562 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 68.6 mt-10 -65.94 -46.07 79.53 Favored 'General case' 0 C--N 1.343 0.316 0 N-CA-C 107.802 -1.184 . . . . 0.0 107.802 178.722 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 27' ' ' ASP . . . . . . . . . . . . . 4.0 t0 -58.9 -48.71 80.48 Favored 'General case' 0 CA--C 1.512 -0.494 0 C-N-CA 127.022 2.129 . . . . 0.0 110.075 179.216 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 28' ' ' GLU . . . . . . . . . . . . . 71.8 tt0 -56.38 -51.03 69.83 Favored 'General case' 0 N--CA 1.455 -0.204 0 CA-C-N 118.892 0.769 . . . . 0.0 109.874 179.53 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 60.8 m -60.94 -56.6 19.21 Favored 'General case' 0 N--CA 1.451 -0.422 0 C-N-CA 122.591 0.356 . . . . 0.0 110.934 -178.846 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 97.8 mt -57.26 -49.87 78.5 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.477 0 C-N-CA 123.001 0.52 . . . . 0.0 111.091 -178.57 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 53.2 ttt180 -59.84 -44.82 93.87 Favored 'General case' 0 CA--C 1.521 -0.171 0 CA-C-N 119.143 0.883 . . . . 0.0 111.284 -179.462 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.42 -45.48 87.39 Favored 'General case' 0 CA--C 1.51 -0.596 0 CA-C-O 118.765 -0.636 . . . . 0.0 110.693 -178.927 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 17.9 tptm -67.26 -46.96 72.13 Favored 'General case' 0 N--CA 1.453 -0.277 0 N-CA-C 109.61 -0.515 . . . . 0.0 109.61 -179.351 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 34' ' ' ALA . . . . . . . . . . . . . . . -56.86 -54.79 42.43 Favored 'General case' 0 N--CA 1.453 -0.292 0 C-N-CA 125.318 1.447 . . . . 0.0 112.693 -179.705 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 5.4 tt0 -70.2 -26.71 64.01 Favored 'General case' 0 C--O 1.233 0.235 0 N-CA-C 112.205 0.446 . . . . 0.0 112.205 -177.372 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 36' ' ' ASP . . . . . . . . . . . . . 15.0 t70 -75.04 -42.54 56.94 Favored 'General case' 0 C--N 1.331 -0.236 0 O-C-N 121.553 -0.717 . . . . 0.0 109.091 178.255 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 37' ' ' SER . . . . . . . . . . . . . 39.6 t -69.83 -23.81 63.36 Favored 'General case' 0 C--O 1.235 0.324 0 C-N-CA 126.017 1.727 . . . . 0.0 111.32 -179.812 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 81.09 23.18 59.65 Favored Glycine 0 CA--C 1.53 0.997 0 N-CA-C 110.355 -1.098 . . . . 0.0 110.355 -178.689 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 39' ' ' LEU . . . . . . . . . . . . . 57.8 mt -120.68 95.08 4.57 Favored 'General case' 0 N--CA 1.447 -0.62 1 N-CA-C 99.827 -4.138 . . . . 0.0 99.827 178.446 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 40' ' ' THR . . . . . . . . . . . . . 4.6 t -48.82 158.83 0.28 Allowed 'General case' 0 N--CA 1.457 -0.102 0 C-N-CA 122.783 0.433 . . . . 0.0 110.358 -178.952 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 41' ' ' VAL . . . . . . . . . . . . . 97.9 t -41.49 -47.9 0.83 Allowed 'Isoleucine or valine' 0 N--CA 1.447 -0.601 0 C-N-CA 124.221 1.008 . . . . 0.0 112.914 -176.828 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 42' ' ' SER . . . . . . . . . . . . . 2.5 p -65.43 -45.75 82.62 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 117.694 -1.603 . . . . 0.0 112.701 -179.403 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -61.02 -45.3 95.37 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 125.346 1.458 . . . . 0.0 110.389 179.225 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 44' ' ' TYR . . . . . . . . . . . . . 9.8 t80 -60.44 -46.29 90.57 Favored 'General case' 0 C--O 1.222 -0.342 0 C-N-CA 123.768 0.827 . . . . 0.0 109.861 179.456 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 45' ' ' ILE . . . . . . . . . . . . . 19.0 mm -57.67 -61.51 1.28 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.355 0 CA-C-N 119.656 1.116 . . . . 0.0 110.228 179.689 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 46' ' ' ARG . . . . . . . . . . . . . 21.7 ptt180 -53.65 -47.51 70.28 Favored 'General case' 0 CA--C 1.528 0.133 0 CA-C-O 119.373 -0.346 . . . . 0.0 111.641 -178.792 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 47' ' ' ASN . . . . . . . . . . . . . 41.9 t30 -64.33 -49.67 70.82 Favored 'General case' 0 C--O 1.234 0.286 0 N-CA-C 114.117 1.154 . . . . 0.0 114.117 -178.989 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -68.1 -21.31 64.97 Favored 'General case' 0 C--O 1.23 0.069 0 C-N-CA 124.19 0.996 . . . . 0.0 112.365 -179.344 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 49' ' ' ALA . . . . . . . . . . . . . . . -87.19 -40.3 14.7 Favored 'General case' 0 N--CA 1.451 -0.404 0 CA-C-N 118.587 0.63 . . . . 0.0 110.975 179.719 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 39.4 mt -68.29 -48.69 64.32 Favored 'General case' 0 C--O 1.233 0.208 0 O-C-N 121.612 -0.68 . . . . 0.0 112.834 -179.055 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 51' ' ' ASN . . . . . . . . . . . . . 44.2 m-80 . . . . . 0 C--O 1.247 0.922 0 CA-C-O 117.445 -1.264 . . . . 0.0 112.565 -177.026 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 1.1 t . . . . . 0 N--CA 1.472 0.64 0 N-CA-C 107.222 -1.399 . . . . 0.0 107.222 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 40.1 t0 -145.34 77.65 1.52 Allowed 'General case' 0 N--CA 1.466 0.325 0 CA-C-O 122.913 1.339 . . . . 0.0 108.415 -179.57 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 2.1 m -67.23 10.09 0.18 Allowed 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 127.743 2.417 . . . . 0.0 115.741 -178.854 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -66.83 102.83 1.0 Allowed 'General case' 0 CA--C 1.534 0.336 0 CA-C-N 120.649 1.568 . . . . 0.0 110.998 -179.42 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 41.2 t -77.32 86.17 0.89 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.39 0 C-N-CA 124.36 1.064 . . . . 0.0 109.138 179.576 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 5.1 ptp85 -78.17 -45.5 23.0 Favored 'General case' 0 C--N 1.332 -0.175 0 O-C-N 121.104 -0.998 . . . . 0.0 108.48 178.332 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 5.3 mptp? -82.94 100.46 10.42 Favored 'General case' 0 N--CA 1.455 -0.192 0 C-N-CA 125.37 1.468 . . . . 0.0 108.578 179.814 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 13.3 mptt -80.88 -66.47 0.88 Allowed 'General case' 0 N--CA 1.468 0.429 0 N-CA-C 105.74 -1.948 . . . . 0.0 105.74 178.71 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 54.3 p -155.67 162.32 40.61 Favored 'General case' 0 C--O 1.242 0.698 0 N-CA-C 105.22 -2.141 . . . . 0.0 105.22 177.599 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 19.4 pt-20 -123.72 3.49 8.88 Favored 'General case' 0 N--CA 1.467 0.388 0 N-CA-C 113.652 0.982 . . . . 0.0 113.652 -179.701 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 38.4 t -66.87 -51.6 53.53 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.405 0 C-N-CA 124.407 1.083 . . . . 0.0 111.329 -179.341 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 16.6 mtm180 -67.69 167.15 13.74 Favored 'General case' 0 N--CA 1.466 0.344 0 N-CA-C 112.88 0.696 . . . . 0.0 112.88 -178.788 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 57.6 mt-30 -86.24 139.74 30.76 Favored 'General case' 0 N--CA 1.448 -0.546 0 N-CA-C 105.552 -2.018 . . . . 0.0 105.552 177.589 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 21.6 ptmt -128.18 -31.05 2.37 Favored 'General case' 0 C--N 1.326 -0.426 0 C-N-CA 126.23 1.812 . . . . 0.0 107.71 178.455 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 3.2 t -72.92 -177.31 2.34 Favored 'General case' 0 N--CA 1.445 -0.687 0 N-CA-C 107.12 -1.437 . . . . 0.0 107.12 177.152 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 3.7 t -131.62 144.3 37.86 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 N-CA-C 106.038 -1.838 . . . . 0.0 106.038 178.435 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 9.4 p -135.61 103.53 4.01 Favored 'Isoleucine or valine' 0 C--O 1.238 0.487 0 N-CA-C 105.931 -1.877 . . . . 0.0 105.931 179.49 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 30.9 ttm180 -139.27 151.09 46.19 Favored 'General case' 0 CA--C 1.514 -0.438 0 CA-C-N 115.005 -0.998 . . . . 0.0 109.516 -179.706 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 19.4 m -103.05 144.6 31.08 Favored 'General case' 0 N--CA 1.449 -0.507 0 N-CA-C 107.344 -1.354 . . . . 0.0 107.344 -179.845 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 54.4 mt -133.32 142.33 48.4 Favored 'General case' 0 C--O 1.236 0.353 0 CA-C-O 121.902 0.858 . . . . 0.0 109.334 179.44 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 10.8 mmt85 -102.18 141.59 34.78 Favored 'General case' 0 N--CA 1.451 -0.389 0 C-N-CA 126.707 2.003 . . . . 0.0 106.809 178.898 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 95.0 m-85 -140.6 143.58 35.33 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 105.418 -2.067 . . . . 0.0 105.418 179.342 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 1.7 m -78.72 165.28 50.61 Favored Pre-proline 0 CA--C 1.539 0.526 0 N-CA-C 108.298 -1.001 . . . . 0.0 108.298 179.851 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -67.5 -21.14 46.86 Favored 'Trans proline' 0 CA--C 1.535 0.539 0 C-N-CA 122.018 1.812 . . . . 0.0 112.107 -179.642 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 16.0 t -82.89 -20.87 9.35 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.409 0 C-N-CA 125.07 1.348 . . . . 0.0 110.687 -179.686 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 93.6 mt-10 -92.61 -46.64 7.5 Favored 'General case' 0 CA--C 1.531 0.23 0 N-CA-C 107.047 -1.464 . . . . 0.0 107.047 178.782 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 2.9 t70 -55.69 -52.7 62.97 Favored 'General case' 0 CA--C 1.507 -0.693 0 C-N-CA 128.601 2.76 . . . . 0.0 112.817 179.792 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -60.99 -38.66 86.79 Favored 'General case' 0 N--CA 1.45 -0.447 0 C-N-CA 119.451 -0.9 . . . . 0.0 110.209 -178.508 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 89.5 m -64.96 -53.01 53.0 Favored 'General case' 0 N--CA 1.451 -0.376 0 CA-C-O 118.83 -0.605 . . . . 0.0 109.628 179.015 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 78.2 mt -56.57 -43.7 79.14 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.203 0 N-CA-C 109.06 -0.718 . . . . 0.0 109.06 -179.708 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 55.2 ttt180 -61.82 -50.6 71.66 Favored 'General case' 0 N--CA 1.455 -0.2 0 C-N-CA 123.734 0.814 . . . . 0.0 110.792 179.402 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 2.4 mptm? -61.86 -46.81 87.84 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-N 118.747 0.703 . . . . 0.0 110.257 -179.101 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 26.0 mmtp -63.74 -45.01 91.83 Favored 'General case' 0 C--O 1.227 -0.124 0 CA-C-N 118.655 0.661 . . . . 0.0 110.322 -179.799 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -60.57 -46.55 89.79 Favored 'General case' 0 C--O 1.237 0.413 0 C-N-CA 123.733 0.813 . . . . 0.0 110.424 179.753 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 27.7 tt0 -67.14 -39.65 86.62 Favored 'General case' 0 N--CA 1.454 -0.263 0 O-C-N 121.849 -0.532 . . . . 0.0 110.815 -179.564 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -67.58 -44.27 78.55 Favored 'General case' 0 N--CA 1.456 -0.168 0 O-C-N 121.747 -0.596 . . . . 0.0 110.347 -179.999 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 6.8 t -69.53 -17.29 63.57 Favored 'General case' 0 N--CA 1.449 -0.516 0 C-N-CA 124.553 1.141 . . . . 0.0 111.764 -178.602 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 75.43 26.42 65.76 Favored Glycine 0 CA--C 1.53 1.001 0 CA-C-N 118.853 0.751 . . . . 0.0 111.353 -179.969 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 88.6 mt -127.78 114.21 16.96 Favored 'General case' 0 N--CA 1.454 -0.233 0 C-N-CA 127.46 2.304 . . . . 0.0 105.517 179.902 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 9.4 t -52.22 154.9 2.16 Favored 'General case' 0 CA--C 1.536 0.421 0 CA-C-N 119.397 0.998 . . . . 0.0 109.664 179.747 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 53.6 t -46.78 -41.95 5.54 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.311 0 C-N-CA 125.407 1.483 . . . . 0.0 112.011 -179.052 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 7.1 p -63.86 -48.84 75.12 Favored 'General case' 0 CA--C 1.541 0.599 0 CA-C-N 119.599 1.09 . . . . 0.0 110.822 179.557 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -62.2 -45.56 92.84 Favored 'General case' 0 C--O 1.223 -0.293 0 C-N-CA 124.837 1.255 . . . . 0.0 109.509 178.621 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 71.6 t80 -54.92 -50.38 68.96 Favored 'General case' 0 N--CA 1.452 -0.351 0 C-N-CA 125.056 1.343 . . . . 0.0 108.802 179.308 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 8.3 mm -56.44 -63.59 0.6 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.316 0 C-N-CA 124.229 1.012 . . . . 0.0 110.505 179.406 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 25.8 ptt180 -55.53 -41.47 73.2 Favored 'General case' 0 N--CA 1.466 0.333 0 O-C-N 121.607 -0.683 . . . . 0.0 111.807 -178.657 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 22.2 t30 -60.81 -53.47 56.93 Favored 'General case' 0 N--CA 1.453 -0.321 0 C-N-CA 123.81 0.844 . . . . 0.0 110.944 179.803 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -63.82 -32.02 73.39 Favored 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 123.532 0.733 . . . . 0.0 112.375 -179.58 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -73.06 -28.73 62.48 Favored 'General case' 0 CA--C 1.531 0.222 0 N-CA-C 113.366 0.876 . . . . 0.0 113.366 -179.317 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 19.2 mt -92.23 -34.74 14.15 Favored 'General case' 0 C--O 1.236 0.381 0 O-C-N 121.912 -0.493 . . . . 0.0 110.758 -179.592 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 28.8 m-80 . . . . . 0 C--O 1.249 1.044 0 C-N-CA 124.438 1.095 . . . . 0.0 108.848 179.896 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 1' ' ' SER . . . . . . . . . . . . . 14.8 m . . . . . 0 N--CA 1.467 0.404 0 N-CA-C 108.165 -1.05 . . . . 0.0 108.165 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 2' ' ' ASP . . . . . . . . . . . . . 16.5 t0 -145.72 152.47 39.64 Favored 'General case' 0 C--O 1.234 0.24 0 N-CA-C 105.707 -1.96 . . . . 0.0 105.707 179.645 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 3' ' ' SER . . . . . . . . . . . . . 13.1 m -137.96 10.98 2.86 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 126.625 1.97 . . . . 0.0 110.386 -179.591 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 4' ' ' ALA . . . . . . . . . . . . . . . -70.54 72.94 0.52 Allowed 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 125.461 1.504 . . . . 0.0 112.895 -179.821 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 97.3 t -72.54 145.23 12.21 Favored 'Isoleucine or valine' 0 C--O 1.238 0.492 0 N-CA-C 105.055 -2.202 . . . . 0.0 105.055 177.544 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 6' ' ' ARG . . . . . . . . . . . . . 40.5 mtp85 -135.26 -54.26 0.79 Allowed 'General case' 0 N--CA 1.467 0.423 0 O-C-N 121.312 -0.868 . . . . 0.0 112.039 -179.26 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 32.1 mmtp -73.43 84.54 1.48 Allowed 'General case' 0 CA--C 1.529 0.163 0 C-N-CA 124.176 0.99 . . . . 0.0 111.609 -178.798 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 14.2 mptt -47.6 -63.88 0.93 Allowed 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 125.055 1.342 . . . . 0.0 109.79 179.087 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 72.4 p -153.09 -178.42 6.93 Favored 'General case' 0 N--CA 1.444 -0.753 0 C-N-CA 126.11 1.764 . . . . 0.0 107.727 -179.364 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 10' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -134.03 4.82 3.54 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 124.274 1.03 . . . . 0.0 112.259 178.363 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 11' ' ' VAL . . . . . . . . . . . . . 72.6 t -71.98 -55.89 11.94 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.239 0 N-CA-C 108.2 -1.037 . . . . 0.0 108.2 179.287 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 12' ' ' ARG . . . . . . . . . . . . . 9.8 mmm180 -54.2 129.16 34.0 Favored 'General case' 0 C--O 1.237 0.425 0 C-N-CA 126.469 1.908 . . . . 0.0 110.177 -178.857 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 13' ' ' GLN . . . . . . . . . . . . . 1.2 pt20 -75.85 96.09 3.63 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 105.294 -2.113 . . . . 0.0 105.294 178.01 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 17.9 ptmt -81.26 -29.74 34.3 Favored 'General case' 0 C--N 1.331 -0.202 0 C-N-CA 123.425 0.69 . . . . 0.0 111.986 -179.348 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 1.9 t -72.01 165.65 23.82 Favored 'General case' 0 N--CA 1.444 -0.747 0 N-CA-C 107.717 -1.216 . . . . 0.0 107.717 178.563 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 38.9 t -108.38 153.89 9.81 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.687 0 N-CA-C 105.884 -1.895 . . . . 0.0 105.884 178.332 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 9.8 p -150.24 103.48 0.33 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.555 0 N-CA-C 107.826 -1.176 . . . . 0.0 107.826 178.885 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 15.7 ttm180 -146.55 152.75 39.46 Favored 'General case' 0 C--N 1.328 -0.344 0 O-C-N 121.355 -0.84 . . . . 0.0 109.783 -179.932 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 7.1 m -96.72 140.08 31.83 Favored 'General case' 0 N--CA 1.448 -0.529 0 C-N-CA 125.446 1.498 . . . . 0.0 108.169 179.322 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 95.0 mt -123.06 165.73 16.31 Favored 'General case' 0 C--O 1.236 0.38 0 N-CA-C 106.965 -1.494 . . . . 0.0 106.965 178.213 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 1.9 mmt85 -125.22 143.92 50.71 Favored 'General case' 0 C--O 1.239 0.525 0 C-N-CA 126.565 1.946 . . . . 0.0 108.34 179.531 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 22' ' ' PHE . . . . . . . . . . . . . 97.4 m-85 -141.41 141.9 33.74 Favored 'General case' 0 CA--C 1.516 -0.347 0 N-CA-C 105.407 -2.071 . . . . 0.0 105.407 179.75 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 4.9 m -79.75 165.0 50.47 Favored Pre-proline 0 C--N 1.324 -0.531 0 CA-C-O 118.432 -0.794 . . . . 0.0 109.171 -179.482 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 24' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -67.27 -5.32 13.55 Favored 'Trans proline' 0 CA--C 1.537 0.645 0 C-N-CA 122.9 2.4 . . . . 0.0 113.165 179.811 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 25' ' ' VAL . . . . . . . . . . . . . 55.4 t -93.85 -61.75 1.99 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.487 0 N-CA-C 104.934 -2.247 . . . . 0.0 104.934 178.713 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 63.6 mt-10 -53.84 -48.12 70.28 Favored 'General case' 0 N--CA 1.455 -0.217 0 C-N-CA 126.186 1.795 . . . . 0.0 110.961 -179.528 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 27' ' ' ASP . . . . . . . . . . . . . 15.5 t70 -61.25 -50.68 72.08 Favored 'General case' 0 CA--C 1.511 -0.526 0 C-N-CA 124.81 1.244 . . . . 0.0 112.048 -179.841 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 28' ' ' GLU . . . . . . . . . . . . . 5.4 tp10 -60.26 -43.57 96.04 Favored 'General case' 0 N--CA 1.449 -0.478 0 N-CA-C 108.645 -0.872 . . . . 0.0 108.645 -179.318 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 53.4 m -59.37 -54.36 47.59 Favored 'General case' 0 N--CA 1.452 -0.339 0 N-CA-C 108.731 -0.84 . . . . 0.0 108.731 178.902 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 71.3 mt -58.53 -43.96 88.15 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.317 0 C-N-CA 123.194 0.597 . . . . 0.0 110.191 -179.524 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 31.5 ttt180 -56.3 -49.44 74.29 Favored 'General case' 0 C--N 1.333 -0.147 0 C-N-CA 123.929 0.891 . . . . 0.0 109.624 179.711 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 1.4 mptm? -67.4 -43.07 82.21 Favored 'General case' 0 C--O 1.223 -0.309 0 CA-C-O 117.758 -1.115 . . . . 0.0 110.757 -179.572 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 29.3 mmtp -63.11 -44.14 96.49 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-N 119.842 1.201 . . . . 0.0 110.665 -179.559 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 34' ' ' ALA . . . . . . . . . . . . . . . -59.32 -56.6 20.02 Favored 'General case' 0 N--CA 1.451 -0.423 0 C-N-CA 124.8 1.24 . . . . 0.0 109.158 179.63 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -61.77 -37.94 86.18 Favored 'General case' 0 C--O 1.236 0.364 0 C-N-CA 123.389 0.676 . . . . 0.0 112.024 -178.688 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 36' ' ' ASP . . . . . . . . . . . . . 9.3 t70 -64.54 -40.7 96.08 Favored 'General case' 0 C--N 1.332 -0.153 0 C-N-CA 125.337 1.455 . . . . 0.0 108.655 178.785 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 37' ' ' SER . . . . . . . . . . . . . 6.2 t -77.78 -8.36 57.9 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 123.738 0.815 . . . . 0.0 110.453 179.013 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 69.45 24.17 76.22 Favored Glycine 0 CA--C 1.531 1.041 0 O-C-N 121.053 -1.029 . . . . 0.0 110.733 -178.991 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 39' ' ' LEU . . . . . . . . . . . . . 71.7 mt -115.99 128.07 55.44 Favored 'General case' 0 N--CA 1.447 -0.595 0 C-N-CA 126.313 1.845 . . . . 0.0 107.399 -179.239 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 40' ' ' THR . . . . . . . . . . . . . 3.5 t -57.31 145.28 32.69 Favored 'General case' 0 CA--C 1.538 0.51 0 N-CA-C 106.717 -1.586 . . . . 0.0 106.717 177.747 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 41' ' ' VAL . . . . . . . . . . . . . 94.1 t -49.8 -41.09 16.63 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.28 0 O-C-N 120.772 -1.205 . . . . 0.0 112.106 -178.735 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 42' ' ' SER . . . . . . . . . . . . . 11.3 m -61.64 -40.75 96.0 Favored 'General case' 0 CA--C 1.541 0.61 0 CA-C-N 119.768 1.167 . . . . 0.0 111.373 -179.648 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -68.59 -44.09 75.08 Favored 'General case' 0 C--O 1.22 -0.477 0 C-N-CA 124.389 1.076 . . . . 0.0 108.097 178.13 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 44' ' ' TYR . . . . . . . . . . . . . 70.6 t80 -55.22 -51.99 64.81 Favored 'General case' 0 N--CA 1.454 -0.254 0 N-CA-C 108.726 -0.842 . . . . 0.0 108.726 179.393 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 45' ' ' ILE . . . . . . . . . . . . . 19.3 mm -53.24 -64.65 0.38 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.23 0 C-N-CA 124.328 1.051 . . . . 0.0 111.47 179.545 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 46' ' ' ARG . . . . . . . . . . . . . 27.1 ptt180 -58.11 -42.06 84.92 Favored 'General case' 0 C--O 1.223 -0.331 0 CA-C-O 118.745 -0.645 . . . . 0.0 111.716 -177.978 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 47' ' ' ASN . . . . . . . . . . . . . 43.8 t30 -60.92 -54.84 40.16 Favored 'General case' 0 N--CA 1.45 -0.474 0 CA-C-O 118.655 -0.688 . . . . 0.0 110.216 -179.72 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -58.78 -31.31 68.27 Favored 'General case' 0 CA--C 1.53 0.201 0 C-N-CA 124.03 0.932 . . . . 0.0 111.56 -179.783 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 49' ' ' ALA . . . . . . . . . . . . . . . -74.86 -20.89 59.55 Favored 'General case' 0 N--CA 1.454 -0.273 0 N-CA-C 113.267 0.84 . . . . 0.0 113.267 -179.708 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 11.8 mt -107.91 -29.02 9.27 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 119.417 1.008 . . . . 0.0 111.592 -179.41 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 51' ' ' ASN . . . . . . . . . . . . . 73.0 m-20 . . . . . 0 C--O 1.245 0.855 0 C-N-CA 126.41 1.884 . . . . 0.0 109.817 -178.99 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 15.2 t . . . . . 0 N--CA 1.474 0.747 0 N-CA-C 107.27 -1.382 . . . . 0.0 107.27 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 12.3 p-10 -99.56 -21.14 16.03 Favored 'General case' 0 C--N 1.327 -0.382 0 C-N-CA 127.168 2.187 . . . . 0.0 112.514 -179.339 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 29.7 t -140.71 146.78 38.23 Favored 'General case' 0 N--CA 1.449 -0.506 0 N-CA-C 106.373 -1.714 . . . . 0.0 106.373 -179.444 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -63.21 150.94 41.79 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-O 121.285 0.564 . . . . 0.0 109.517 179.603 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 13.5 p -69.86 -25.75 28.83 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.601 0 O-C-N 122.094 -0.379 . . . . 0.0 110.58 179.705 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 70.5 mtp180 -106.25 133.74 50.48 Favored 'General case' 0 C--N 1.338 0.097 0 N-CA-C 106.772 -1.566 . . . . 0.0 106.772 179.122 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 21.2 pttp -149.1 -51.6 0.16 Allowed 'General case' 0 C--N 1.332 -0.191 0 C-N-CA 124.946 1.298 . . . . 0.0 109.012 179.416 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 15.5 mmtp -71.68 101.25 2.5 Favored 'General case' 0 C--O 1.234 0.253 0 N-CA-C 106.864 -1.532 . . . . 0.0 106.864 178.639 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 52.1 m -166.34 143.02 4.97 Favored 'General case' 0 C--O 1.235 0.341 0 C-N-CA 124.86 1.264 . . . . 0.0 109.329 178.58 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER 178.19 157.23 0.43 Allowed 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 128.915 2.886 . . . . 0.0 107.906 178.643 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 7.8 p -128.52 -22.09 1.58 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.422 0 C-N-CA 124.892 1.277 . . . . 0.0 111.775 -179.792 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 32.7 mtt85 -148.3 126.77 12.36 Favored 'General case' 0 N--CA 1.45 -0.437 0 N-CA-C 105.715 -1.957 . . . . 0.0 105.715 179.779 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 66.1 mt-30 -59.54 98.46 0.05 OUTLIER 'General case' 0 C--N 1.331 -0.226 0 C-N-CA 124.515 1.126 . . . . 0.0 109.013 -179.715 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 19.4 ptmt -77.76 -34.93 52.22 Favored 'General case' 0 N--CA 1.464 0.259 0 C-N-CA 123.001 0.52 . . . . 0.0 110.696 179.714 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 4.3 t -64.17 164.38 11.0 Favored 'General case' 0 N--CA 1.445 -0.691 0 C-N-CA 123.785 0.834 . . . . 0.0 109.409 179.227 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 1.4 t -125.62 102.76 10.8 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.457 0 C-N-CA 123.562 0.745 . . . . 0.0 110.187 -177.9 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 3.1 p -101.25 127.51 54.45 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.412 0 C-N-CA 124.133 0.973 . . . . 0.0 110.872 -178.035 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 14.8 ttm180 -154.66 160.92 41.71 Favored 'General case' 0 C--O 1.237 0.399 0 N-CA-C 108.771 -0.826 . . . . 0.0 108.771 178.045 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 7.1 m -90.76 91.61 8.45 Favored 'General case' 0 C--O 1.237 0.401 0 N-CA-C 107.473 -1.306 . . . . 0.0 107.473 179.565 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -97.84 100.78 12.15 Favored 'General case' 0 C--O 1.236 0.393 0 N-CA-C 107.568 -1.271 . . . . 0.0 107.568 179.147 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 32.9 mtt180 -87.57 159.03 18.75 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 108.992 -0.744 . . . . 0.0 108.992 179.585 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 86.0 m-85 -136.58 152.02 50.01 Favored 'General case' 0 CA--C 1.511 -0.535 0 N-CA-C 108.151 -1.055 . . . . 0.0 108.151 -179.765 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -82.88 171.83 10.84 Favored Pre-proline 0 CA--C 1.539 0.525 0 N-CA-C 107.48 -1.304 . . . . 0.0 107.48 179.664 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -67.24 -37.26 18.68 Favored 'Trans proline' 0 N--CA 1.457 -0.66 0 C-N-CA 121.483 1.455 . . . . 0.0 112.712 -178.473 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 92.3 t -66.58 -53.06 39.2 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.324 0 N-CA-C 107.825 -1.176 . . . . 0.0 107.825 179.508 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 -57.84 -47.24 83.25 Favored 'General case' 0 N--CA 1.455 -0.182 0 C-N-CA 122.941 0.496 . . . . 0.0 110.443 179.576 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 21.7 t70 -59.54 -52.27 66.29 Favored 'General case' 0 CA--C 1.507 -0.676 0 C-N-CA 123.147 0.579 . . . . 0.0 111.257 -179.979 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -56.1 -38.54 70.89 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 118.351 0.523 . . . . 0.0 110.594 -179.456 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 25.9 m -67.05 -56.48 9.9 Favored 'General case' 0 N--CA 1.449 -0.495 0 C-N-CA 123.359 0.664 . . . . 0.0 109.874 179.527 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 88.2 mt -60.16 -38.89 78.85 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.252 0 C-N-CA 123.834 0.854 . . . . 0.0 109.758 -179.394 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 64.4 ttt180 -61.86 -51.72 67.05 Favored 'General case' 0 C--O 1.223 -0.293 0 C-N-CA 124.857 1.263 . . . . 0.0 108.341 179.217 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 2.6 mptp? -59.42 -48.97 79.61 Favored 'General case' 0 CA--C 1.515 -0.381 0 C-N-CA 123.305 0.642 . . . . 0.0 109.529 179.78 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 64.4 mmtt -60.88 -45.72 93.47 Favored 'General case' 0 CA--C 1.509 -0.626 0 CA-C-O 118.565 -0.731 . . . . 0.0 111.871 -178.943 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -63.41 -53.71 48.12 Favored 'General case' 0 N--CA 1.446 -0.665 0 O-C-N 123.595 0.559 . . . . 0.0 110.161 -179.256 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -61.13 -36.88 80.91 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 123.378 0.671 . . . . 0.0 111.824 -177.866 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -73.41 -33.77 65.13 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 125.331 1.452 . . . . 0.0 109.696 178.752 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 30.0 t -72.71 -13.69 61.4 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 125.079 1.352 . . . . 0.0 108.09 177.55 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 82.95 -9.88 59.06 Favored Glycine 0 C--N 1.338 0.694 0 C-N-CA 125.639 1.59 . . . . 0.0 111.784 -179.01 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 82.6 mt -86.3 173.25 9.86 Favored 'General case' 0 N--CA 1.439 -0.98 0 C-N-CA 126.0 1.72 . . . . 0.0 107.222 179.745 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -96.51 157.09 16.06 Favored 'General case' 0 C--N 1.317 -0.844 0 N-CA-C 104.548 -2.389 . . . . 0.0 104.548 177.362 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 84.3 t -51.01 -40.9 21.51 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.382 0 C-N-CA 123.635 0.774 . . . . 0.0 109.503 178.731 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 10.5 p -60.99 -45.05 96.35 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-N 120.428 1.467 . . . . 0.0 112.012 -179.652 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -66.68 -48.39 69.47 Favored 'General case' 0 C--O 1.225 -0.185 0 C-N-CA 123.973 0.909 . . . . 0.0 109.523 179.104 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 87.9 t80 -56.52 -47.13 80.01 Favored 'General case' 0 CA--C 1.538 0.503 0 N-CA-C 109.584 -0.524 . . . . 0.0 109.584 179.819 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 5.9 mm -54.58 -64.45 0.44 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.357 0 C-N-CA 124.896 1.278 . . . . 0.0 110.592 179.477 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 13.1 ptm180 -56.08 -45.06 79.49 Favored 'General case' 0 C--O 1.219 -0.5 0 CA-C-O 118.97 -0.538 . . . . 0.0 110.889 -178.744 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 43.0 t30 -59.28 -54.91 41.45 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-N 118.405 0.548 . . . . 0.0 111.901 -179.299 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -61.81 -29.93 70.48 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 123.813 0.845 . . . . 0.0 111.596 -179.603 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -75.0 -23.06 58.18 Favored 'General case' 0 C--O 1.223 -0.291 0 N-CA-C 113.615 0.969 . . . . 0.0 113.615 179.84 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 6.9 mt -99.93 -39.1 8.33 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 119.62 1.1 . . . . 0.0 112.174 -178.643 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 22.0 m-80 . . . . . 0 C--O 1.254 1.325 0 CA-C-O 116.329 -1.796 . . . . 0.0 113.187 -178.817 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 1' ' ' SER . . . . . . . . . . . . . 1.2 t . . . . . 0 N--CA 1.47 0.542 0 N-CA-C 105.311 -2.107 . . . . 0.0 105.311 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 2' ' ' ASP . . . . . . . . . . . . . 5.6 p-10 -146.33 -45.79 0.19 Allowed 'General case' 0 C--N 1.327 -0.408 0 O-C-N 124.313 1.008 . . . . 0.0 109.808 -178.446 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 3' ' ' SER . . . . . . . . . . . . . 4.4 t -136.51 153.5 51.0 Favored 'General case' 0 N--CA 1.448 -0.525 0 N-CA-C 108.698 -0.853 . . . . 0.0 108.698 -179.583 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 4' ' ' ALA . . . . . . . . . . . . . . . -61.64 141.84 57.55 Favored 'General case' 0 C--O 1.233 0.211 0 C-N-CA 122.761 0.424 . . . . 0.0 110.066 179.847 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 11.1 p -62.14 -15.4 14.1 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.588 0 C-N-CA 124.621 1.168 . . . . 0.0 113.288 -179.678 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 6' ' ' ARG . . . . . . . . . . . . . 46.9 mtm180 -114.52 129.49 56.67 Favored 'General case' 0 CA--C 1.519 -0.214 0 O-C-N 120.734 -1.229 . . . . 0.0 108.131 179.171 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 20.7 pttp -137.16 -45.76 0.57 Allowed 'General case' 0 CA--C 1.519 -0.237 0 CA-C-O 118.489 -0.767 . . . . 0.0 111.617 178.07 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 9.3 mtmp? -72.47 92.32 1.46 Allowed 'General case' 0 C--O 1.232 0.175 0 CA-C-N 119.292 0.951 . . . . 0.0 109.862 179.831 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 44.3 m -140.17 97.64 3.28 Favored 'General case' 0 C--N 1.331 -0.238 0 C-N-CA 125.205 1.402 . . . . 0.0 107.341 179.254 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 10' ' ' GLU . . . . . . . . . . . . . 28.1 tt0 -135.49 124.02 23.55 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 105.465 -2.05 . . . . 0.0 105.465 179.286 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 11' ' ' VAL . . . . . . . . . . . . . 88.7 t -114.52 -29.28 2.23 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.481 0 C-N-CA 124.542 1.137 . . . . 0.0 109.665 -179.588 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -146.13 135.08 22.55 Favored 'General case' 0 C--O 1.238 0.486 0 N-CA-C 105.006 -2.22 . . . . 0.0 105.006 178.803 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 13' ' ' GLN . . . . . . . . . . . . . 68.7 mt-30 -76.74 83.49 3.36 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 122.62 1.2 . . . . 0.0 108.735 -179.251 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 46.4 pttt -70.43 -21.16 62.85 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 115.399 -0.818 . . . . 0.0 111.772 179.388 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 4.6 t -78.12 173.15 12.54 Favored 'General case' 0 N--CA 1.449 -0.505 0 N-CA-C 108.202 -1.036 . . . . 0.0 108.202 178.472 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 24.7 t -116.28 148.18 19.17 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.504 0 N-CA-C 106.524 -1.658 . . . . 0.0 106.524 179.146 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 10.7 p -141.25 106.26 1.7 Allowed 'Isoleucine or valine' 0 N--CA 1.447 -0.614 0 N-CA-C 107.299 -1.371 . . . . 0.0 107.299 177.644 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 33.0 ttm180 -136.51 159.74 40.88 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.32 -0.855 . . . . 0.0 109.228 179.911 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 11.6 m -97.38 87.62 4.19 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 107.42 -1.326 . . . . 0.0 107.42 -179.78 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -81.82 105.49 12.99 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 108.812 -0.81 . . . . 0.0 108.812 -179.806 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 10.1 mtm180 -93.7 142.28 27.54 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 126.56 1.944 . . . . 0.0 110.918 -179.885 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 22' ' ' PHE . . . . . . . . . . . . . 78.0 m-85 -129.56 170.52 13.65 Favored 'General case' 0 N--CA 1.482 1.128 0 C-N-CA 125.192 1.397 . . . . 0.0 111.365 -179.15 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 2.0 m -99.09 166.03 13.78 Favored Pre-proline 0 CA--C 1.538 0.483 0 N-CA-C 108.04 -1.096 . . . . 0.0 108.04 178.809 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 24' ' ' PRO . . . . . . . . . . . . . 70.6 Cg_endo -69.16 -28.43 28.15 Favored 'Trans proline' 0 N--CA 1.458 -0.561 0 C-N-CA 121.442 1.428 . . . . 0.0 112.398 -179.72 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 25' ' ' VAL . . . . . . . . . . . . . 96.1 t -67.51 -56.75 12.12 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.31 0 N-CA-C 106.751 -1.574 . . . . 0.0 106.751 179.249 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 1.4 mp0 -56.44 -44.05 80.09 Favored 'General case' 0 CA--C 1.528 0.114 0 C-N-CA 124.92 1.288 . . . . 0.0 111.432 179.53 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 27' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -62.78 -37.53 87.05 Favored 'General case' 0 CA--C 1.517 -0.3 0 N-CA-C 113.131 0.789 . . . . 0.0 113.131 -179.628 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 28' ' ' GLU . . . . . . . . . . . . . 32.3 tt0 -61.62 -50.82 71.0 Favored 'General case' 0 N--CA 1.45 -0.439 0 N-CA-C 107.141 -1.429 . . . . 0.0 107.141 178.963 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 30.3 m -58.83 -59.22 5.78 Favored 'General case' 0 N--CA 1.451 -0.395 0 C-N-CA 124.489 1.116 . . . . 0.0 111.279 -179.473 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 74.9 mt -56.67 -46.12 82.83 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.22 0 C-N-CA 124.45 1.1 . . . . 0.0 110.24 -178.78 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 56.4 ttt180 -62.22 -45.45 93.3 Favored 'General case' 0 CA--C 1.518 -0.279 0 CA-C-N 119.288 0.949 . . . . 0.0 111.255 -179.499 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 4.9 mptp? -60.05 -51.37 69.91 Favored 'General case' 0 CA--C 1.515 -0.397 0 N-CA-C 109.802 -0.444 . . . . 0.0 109.802 -179.059 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 37.2 mmtt -60.27 -52.99 62.92 Favored 'General case' 0 N--CA 1.449 -0.512 0 O-C-N 124.431 1.082 . . . . 0.0 111.022 -179.035 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 34' ' ' ALA . . . . . . . . . . . . . . . -55.94 -54.05 49.42 Favored 'General case' 0 N--CA 1.45 -0.467 0 C-N-CA 123.674 0.79 . . . . 0.0 111.318 -178.818 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 24.6 tt0 -63.16 -42.77 99.47 Favored 'General case' 0 N--CA 1.451 -0.406 0 N-CA-C 112.588 0.588 . . . . 0.0 112.588 -178.094 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 36' ' ' ASP . . . . . . . . . . . . . 26.9 t70 -65.64 -36.9 85.02 Favored 'General case' 0 C--O 1.232 0.143 0 C-N-CA 123.586 0.754 . . . . 0.0 110.502 -179.888 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 37' ' ' SER . . . . . . . . . . . . . 12.4 t -78.83 -7.25 57.7 Favored 'General case' 0 N--CA 1.446 -0.629 0 C-N-CA 123.995 0.918 . . . . 0.0 110.819 179.261 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 70.62 10.34 66.92 Favored Glycine 0 CA--C 1.536 1.346 0 CA-C-N 119.732 1.151 . . . . 0.0 113.28 -179.616 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 39' ' ' LEU . . . . . . . . . . . . . 15.2 mt -108.92 107.56 17.99 Favored 'General case' 0 N--CA 1.451 -0.382 0 N-CA-C 103.961 -2.607 . . . . 0.0 103.961 179.475 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 40' ' ' THR . . . . . . . . . . . . . 13.5 t -46.74 151.66 0.57 Allowed 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 123.808 0.843 . . . . 0.0 109.969 179.582 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 41' ' ' VAL . . . . . . . . . . . . . 58.8 t -43.62 -43.14 1.64 Allowed 'Isoleucine or valine' 0 CA--C 1.527 0.07 0 C-N-CA 125.441 1.496 . . . . 0.0 111.902 -178.109 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 42' ' ' SER . . . . . . . . . . . . . 5.4 p -66.55 -43.64 84.52 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-N 119.588 1.085 . . . . 0.0 112.747 179.458 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.72 -40.76 97.55 Favored 'General case' 0 C--O 1.232 0.137 0 N-CA-C 109.175 -0.676 . . . . 0.0 109.175 178.583 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 44' ' ' TYR . . . . . . . . . . . . . 64.3 t80 -60.6 -53.31 59.04 Favored 'General case' 0 N--CA 1.442 -0.841 0 N-CA-C 107.975 -1.12 . . . . 0.0 107.975 179.146 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 45' ' ' ILE . . . . . . . . . . . . . 19.7 mm -55.04 -54.46 23.85 Favored 'Isoleucine or valine' 0 C--N 1.341 0.231 0 C-N-CA 123.387 0.675 . . . . 0.0 109.285 179.521 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 46' ' ' ARG . . . . . . . . . . . . . 1.1 mtp180 -47.29 -64.59 0.74 Allowed 'General case' 0 C--O 1.22 -0.465 0 C-N-CA 124.138 0.975 . . . . 0.0 109.902 179.43 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 47' ' ' ASN . . . . . . . . . . . . . 27.4 t30 -54.19 -51.15 65.3 Favored 'General case' 0 C--N 1.325 -0.499 0 C-N-CA 126.583 1.953 . . . . 0.0 113.763 -177.944 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -60.39 -29.28 68.84 Favored 'General case' 0 N--CA 1.453 -0.324 0 C-N-CA 122.997 0.519 . . . . 0.0 112.362 -179.062 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 49' ' ' ALA . . . . . . . . . . . . . . . -86.41 -12.42 49.21 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 113.675 0.991 . . . . 0.0 113.675 -179.306 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 11.2 mt -104.86 -29.09 10.73 Favored 'General case' 0 CA--C 1.516 -0.353 0 O-C-N 121.213 -0.929 . . . . 0.0 111.154 -178.932 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 51' ' ' ASN . . . . . . . . . . . . . 74.4 m-80 . . . . . 0 C--O 1.249 1.04 0 C-N-CA 125.337 1.455 . . . . 0.0 111.298 -179.057 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 8.7 t . . . . . 0 N--CA 1.482 1.142 0 CA-C-O 122.978 1.371 . . . . 0.0 108.273 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -72.92 -43.69 62.1 Favored 'General case' 0 C--N 1.32 -0.717 1 C-N-CA 134.35 5.06 . . . . 0.0 110.324 -177.142 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 59.0 m -105.98 124.31 49.37 Favored 'General case' 0 N--CA 1.447 -0.586 0 C-N-CA 125.171 1.388 . . . . 0.0 107.291 179.178 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -151.37 156.27 40.38 Favored 'General case' 0 C--O 1.242 0.663 0 C-N-CA 125.061 1.345 . . . . 0.0 108.084 179.728 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 27.0 m -60.67 152.69 5.37 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.276 0 C-N-CA 124.2 1.0 . . . . 0.0 109.357 179.438 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 18.7 ptp180 -160.26 152.73 20.85 Favored 'General case' 0 CA--C 1.521 -0.158 0 O-C-N 121.512 -0.742 . . . . 0.0 109.744 -179.544 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 41.1 mttm -71.24 152.54 43.21 Favored 'General case' 0 C--O 1.235 0.332 0 N-CA-C 106.228 -1.767 . . . . 0.0 106.228 178.144 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -133.72 -77.52 0.47 Allowed 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 105.814 -1.921 . . . . 0.0 105.814 179.122 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 71.5 m -142.95 -167.7 2.6 Favored 'General case' 0 C--N 1.326 -0.417 0 C-N-CA 126.366 1.867 . . . . 0.0 106.347 178.893 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -153.61 -159.74 1.02 Allowed 'General case' 0 C--O 1.241 0.608 0 O-C-N 121.002 -1.061 . . . . 0.0 108.867 -179.864 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 1.4 m -55.69 113.63 0.53 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.249 0 C-N-CA 124.783 1.233 . . . . 0.0 108.701 178.994 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 6.2 ptp85 -65.32 -27.26 68.48 Favored 'General case' 0 N--CA 1.469 0.519 0 O-C-N 121.398 -0.814 . . . . 0.0 110.115 179.033 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 52.2 tt0 -124.61 99.09 6.01 Favored 'General case' 0 N--CA 1.443 -0.776 0 C-N-CA 128.565 2.746 . . . . 0.0 104.629 -179.812 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 21.1 ptmt -72.25 -36.84 69.17 Favored 'General case' 0 N--CA 1.464 0.227 0 C-N-CA 124.64 1.176 . . . . 0.0 109.872 179.576 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 3.1 t -72.21 162.56 29.3 Favored 'General case' 0 N--CA 1.451 -0.391 0 N-CA-C 107.691 -1.226 . . . . 0.0 107.691 178.507 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 2.5 t -107.29 145.87 14.18 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.764 0 N-CA-C 106.552 -1.648 . . . . 0.0 106.552 179.142 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 14.5 p -140.69 110.26 3.24 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.765 0 N-CA-C 105.209 -2.145 . . . . 0.0 105.209 178.298 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 21.6 ttt85 -144.72 -175.86 4.83 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 109.348 -0.612 . . . . 0.0 109.348 -178.945 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 13.4 m -119.35 112.43 19.42 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-N 118.82 0.737 . . . . 0.0 110.519 -179.107 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -105.56 100.74 10.3 Favored 'General case' 0 C--O 1.236 0.344 0 C-N-CA 125.788 1.635 . . . . 0.0 107.64 179.788 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 6.1 mtt180 -84.97 157.46 20.79 Favored 'General case' 0 C--O 1.234 0.239 0 N-CA-C 108.437 -0.949 . . . . 0.0 108.437 177.937 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 92.7 m-85 -140.24 152.54 46.03 Favored 'General case' 0 C--O 1.236 0.359 0 N-CA-C 107.38 -1.341 . . . . 0.0 107.38 179.629 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 1.5 m -83.06 171.59 11.34 Favored Pre-proline 0 CA--C 1.547 0.832 0 CA-C-O 117.772 -1.109 . . . . 0.0 108.233 179.602 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_endo -63.75 -48.44 5.48 Favored 'Trans proline' 0 C--N 1.347 0.497 0 C-N-CA 122.025 1.817 . . . . 0.0 114.713 -177.417 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 93.9 t -64.63 -37.96 81.42 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.337 0 C-N-CA 124.787 1.235 . . . . 0.0 110.375 -179.603 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -64.33 -53.48 48.14 Favored 'General case' 0 N--CA 1.454 -0.264 0 C-N-CA 125.526 1.53 . . . . 0.0 108.043 -179.576 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 3.5 t70 -60.24 -42.91 96.27 Favored 'General case' 0 C--N 1.331 -0.204 0 C-N-CA 127.479 2.312 . . . . 0.0 111.425 179.583 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 88.7 tt0 -63.88 -49.39 72.89 Favored 'General case' 0 N--CA 1.45 -0.434 0 N-CA-C 108.018 -1.105 . . . . 0.0 108.018 179.135 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 91.2 m -58.54 -49.78 76.17 Favored 'General case' 0 CA--C 1.533 0.325 0 N-CA-C 109.169 -0.678 . . . . 0.0 109.169 179.274 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 34.0 mt -58.07 -46.34 88.15 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.303 0 C-N-CA 123.307 0.643 . . . . 0.0 109.38 179.54 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 29.1 ttt180 -60.36 -51.19 70.55 Favored 'General case' 0 CA--C 1.518 -0.284 0 CA-C-N 118.784 0.72 . . . . 0.0 110.839 -179.626 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 1.7 mptm? -61.85 -44.9 95.9 Favored 'General case' 0 CA--C 1.52 -0.21 0 CA-C-O 118.547 -0.74 . . . . 0.0 109.691 -179.092 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 38.4 tptt -64.57 -38.97 92.83 Favored 'General case' 0 C--O 1.224 -0.255 0 CA-C-N 118.905 0.775 . . . . 0.0 110.694 -179.614 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -63.46 -54.67 32.82 Favored 'General case' 0 C--O 1.234 0.263 0 C-N-CA 125.258 1.423 . . . . 0.0 108.578 178.839 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 7.4 tp10 -59.16 -40.05 84.4 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 124.324 1.049 . . . . 0.0 110.48 -179.364 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -71.38 -37.24 71.59 Favored 'General case' 0 CA--C 1.53 0.199 0 C-N-CA 125.751 1.62 . . . . 0.0 111.713 179.704 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 22.7 t -76.67 -15.63 59.75 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 124.441 1.096 . . . . 0.0 111.393 179.784 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 77.54 34.43 39.91 Favored Glycine 0 CA--C 1.53 0.97 0 N-CA-C 110.017 -1.233 . . . . 0.0 110.017 -179.121 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 90.8 mt -136.49 132.69 35.66 Favored 'General case' 0 CA--C 1.514 -0.424 0 N-CA-C 106.735 -1.58 . . . . 0.0 106.735 179.792 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 6.7 t -62.68 150.91 39.77 Favored 'General case' 0 CA--C 1.537 0.471 0 N-CA-C 107.544 -1.28 . . . . 0.0 107.544 178.616 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 41.7 t -47.09 -45.13 8.3 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.446 0 C-N-CA 125.025 1.33 . . . . 0.0 111.513 -179.752 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 56.7 p -56.73 -45.5 81.9 Favored 'General case' 0 CA--C 1.535 0.39 0 CA-C-N 119.029 0.831 . . . . 0.0 111.922 -179.625 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -71.72 -44.33 64.34 Favored 'General case' 0 N--CA 1.449 -0.48 0 C-N-CA 124.369 1.068 . . . . 0.0 109.5 179.104 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 93.2 t80 -52.1 -48.75 64.6 Favored 'General case' 0 CA--C 1.53 0.182 0 C-N-CA 124.519 1.128 . . . . 0.0 109.196 179.79 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 24.2 mm -55.74 -66.61 0.27 Allowed 'Isoleucine or valine' 0 C--O 1.226 -0.143 0 C-N-CA 123.918 0.887 . . . . 0.0 111.411 179.626 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 15.7 ptt180 -58.54 -45.39 89.0 Favored 'General case' 0 C--O 1.219 -0.516 0 CA-C-O 118.398 -0.81 . . . . 0.0 112.001 -177.811 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 16.6 t30 -55.34 -47.72 75.27 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 119.153 0.888 . . . . 0.0 111.451 -179.41 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -67.51 -30.9 70.69 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 122.823 0.449 . . . . 0.0 111.896 179.452 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -77.58 -29.01 51.87 Favored 'General case' 0 N--CA 1.451 -0.418 0 C-N-CA 124.245 1.018 . . . . 0.0 113.432 -179.65 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 8.9 mt -89.23 -39.52 13.47 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 113.279 0.844 . . . . 0.0 113.279 -178.33 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 65.7 m-20 . . . . . 0 C--O 1.251 1.181 0 C-N-CA 123.566 0.746 . . . . 0.0 112.657 -178.446 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 1' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.484 1.242 0 CA-C-O 124.525 2.107 . . . . 0.0 105.579 . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 2' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -86.89 -56.19 3.5 Favored 'General case' 0 C--N 1.317 -0.812 1 C-N-CA 136.133 5.773 . . . . 0.0 107.858 -176.166 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 3' ' ' SER . . . . . . . . . . . . . 58.8 m -101.22 125.99 47.9 Favored 'General case' 0 N--CA 1.45 -0.462 0 N-CA-C 107.316 -1.365 . . . . 0.0 107.316 178.987 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 4' ' ' ALA . . . . . . . . . . . . . . . -143.92 143.59 31.33 Favored 'General case' 0 C--O 1.24 0.569 0 N-CA-C 107.592 -1.262 . . . . 0.0 107.592 179.292 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 12.4 p -54.96 144.49 6.04 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.313 0 C-N-CA 124.855 1.262 . . . . 0.0 110.014 -179.761 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 6' ' ' ARG . . . . . . . . . . . . . 17.2 ptp180 -159.47 158.54 32.17 Favored 'General case' 0 C--N 1.333 -0.115 0 C-N-CA 125.005 1.322 . . . . 0.0 107.537 -179.802 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 10.1 pttp -63.04 150.56 42.22 Favored 'General case' 0 C--O 1.233 0.213 0 O-C-N 123.353 0.408 . . . . 0.0 111.785 -179.324 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 1.4 tmtp? -140.0 -64.55 0.48 Allowed 'General case' 0 C--O 1.233 0.227 0 N-CA-C 107.87 -1.159 . . . . 0.0 107.87 178.898 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 5.4 m -135.25 175.22 9.78 Favored 'General case' 0 C--N 1.332 -0.172 0 C-N-CA 125.063 1.345 . . . . 0.0 110.234 179.9 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 10' ' ' GLU . . . . . . . . . . . . . 23.2 tt0 -148.31 179.66 7.61 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 124.93 1.292 . . . . 0.0 108.293 -179.842 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 11' ' ' VAL . . . . . . . . . . . . . 12.7 m -61.65 111.16 0.7 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.347 0 N-CA-C 108.056 -1.09 . . . . 0.0 108.056 179.273 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 12' ' ' ARG . . . . . . . . . . . . . 10.1 ptp85 -59.24 -32.26 69.81 Favored 'General case' 0 N--CA 1.464 0.262 0 N-CA-C 113.473 0.916 . . . . 0.0 113.473 -178.252 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 13' ' ' GLN . . . . . . . . . . . . . 9.7 tt0 -120.67 94.71 4.45 Favored 'General case' 0 N--CA 1.452 -0.333 0 N-CA-C 105.775 -1.935 . . . . 0.0 105.775 -179.58 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 19.5 ptmt -62.88 -32.7 74.01 Favored 'General case' 0 N--CA 1.455 -0.215 0 C-N-CA 124.137 0.975 . . . . 0.0 109.74 179.295 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 4.3 t -81.88 163.07 22.52 Favored 'General case' 0 N--CA 1.449 -0.5 0 N-CA-C 108.059 -1.089 . . . . 0.0 108.059 178.594 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 5.8 t -107.18 157.07 7.45 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 N-CA-C 106.34 -1.726 . . . . 0.0 106.34 178.405 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 10.9 p -151.21 120.4 0.87 Allowed 'Isoleucine or valine' 0 N--CA 1.444 -0.76 0 N-CA-C 105.017 -2.216 . . . . 0.0 105.017 178.585 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 4.9 ttt85 -145.96 175.67 10.27 Favored 'General case' 0 C--O 1.238 0.457 0 C-N-CA 119.646 -0.822 . . . . 0.0 111.702 -179.845 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 20.9 m -115.27 76.67 1.01 Allowed 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 106.708 -1.59 . . . . 0.0 106.708 -179.631 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 52.6 tp -89.52 93.16 9.39 Favored 'General case' 0 N--CA 1.448 -0.558 0 C-N-CA 127.362 2.265 . . . . 0.0 107.935 -179.212 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 41.2 mtt180 -76.89 164.56 25.69 Favored 'General case' 0 C--N 1.326 -0.44 0 C-N-CA 123.715 0.806 . . . . 0.0 110.963 -179.728 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 22' ' ' PHE . . . . . . . . . . . . . 69.3 m-85 -142.47 148.56 37.91 Favored 'General case' 0 C--O 1.237 0.395 0 N-CA-C 107.57 -1.27 . . . . 0.0 107.57 179.849 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 49.3 m -79.62 166.12 43.25 Favored Pre-proline 0 CA--C 1.541 0.612 0 N-CA-C 107.771 -1.196 . . . . 0.0 107.771 179.33 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 24' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -64.73 -35.43 46.21 Favored 'Trans proline' 0 C--N 1.348 0.517 0 C-N-CA 121.517 1.478 . . . . 0.0 112.118 -178.696 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 25' ' ' VAL . . . . . . . . . . . . . 89.4 t -60.62 -55.25 25.71 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.375 0 N-CA-C 108.219 -1.03 . . . . 0.0 108.219 179.392 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 4.2 mm-40 -59.92 -44.48 94.3 Favored 'General case' 0 CA--C 1.53 0.206 0 C-N-CA 125.338 1.455 . . . . 0.0 111.109 -178.977 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 27' ' ' ASP . . . . . . . . . . . . . 13.5 t70 -60.97 -46.08 92.17 Favored 'General case' 0 CA--C 1.514 -0.407 0 C-N-CA 125.64 1.576 . . . . 0.0 111.234 179.828 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 28' ' ' GLU . . . . . . . . . . . . . 87.6 tt0 -60.51 -48.18 82.9 Favored 'General case' 0 N--CA 1.448 -0.534 0 N-CA-C 108.387 -0.968 . . . . 0.0 108.387 179.098 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 39.2 m -57.02 -58.08 9.74 Favored 'General case' 0 CA--C 1.536 0.414 0 N-CA-C 109.449 -0.575 . . . . 0.0 109.449 179.522 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 63.4 mt -57.67 -44.02 84.75 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.314 0 C-N-CA 124.456 1.103 . . . . 0.0 111.093 -178.761 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 20.4 ttt180 -61.94 -49.55 75.69 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 119.133 0.879 . . . . 0.0 110.508 179.889 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 1.2 mptm? -62.75 -44.24 96.72 Favored 'General case' 0 CA--C 1.518 -0.252 0 O-C-N 123.463 0.477 . . . . 0.0 110.033 -178.102 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 36.3 tptt -67.94 -43.41 79.16 Favored 'General case' 0 C--O 1.221 -0.436 0 CA-C-O 118.714 -0.66 . . . . 0.0 111.155 -179.584 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 34' ' ' ALA . . . . . . . . . . . . . . . -57.64 -52.29 66.04 Favored 'General case' 0 C--N 1.329 -0.286 0 C-N-CA 124.029 0.932 . . . . 0.0 110.646 179.819 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 31.1 tp10 -63.36 -37.51 87.55 Favored 'General case' 0 CA--C 1.534 0.331 0 N-CA-C 110.46 -0.2 . . . . 0.0 110.46 -178.841 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 36' ' ' ASP . . . . . . . . . . . . . 34.8 t70 -69.28 -41.34 76.98 Favored 'General case' 0 C--O 1.232 0.156 0 C-N-CA 124.419 1.088 . . . . 0.0 111.038 179.741 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 37' ' ' SER . . . . . . . . . . . . . 1.4 t -70.16 -27.17 64.32 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 124.253 1.021 . . . . 0.0 108.886 179.23 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 85.71 22.4 50.26 Favored Glycine 0 CA--C 1.53 1.007 0 N-CA-C 109.959 -1.257 . . . . 0.0 109.959 -178.933 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 39' ' ' LEU . . . . . . . . . . . . . 86.9 mt -122.99 115.0 21.17 Favored 'General case' 0 CA--C 1.508 -0.661 0 N-CA-C 104.034 -2.58 . . . . 0.0 104.034 -179.823 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 40' ' ' THR . . . . . . . . . . . . . 9.0 t -51.9 158.57 1.01 Allowed 'General case' 0 CA--C 1.534 0.345 0 N-CA-C 109.741 -0.466 . . . . 0.0 109.741 179.299 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 41' ' ' VAL . . . . . . . . . . . . . 94.4 t -46.64 -42.11 5.38 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.294 0 C-N-CA 124.201 1.0 . . . . 0.0 112.086 -178.899 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 42' ' ' SER . . . . . . . . . . . . . 19.4 p -64.33 -46.79 81.96 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-N 120.516 1.507 . . . . 0.0 112.109 179.704 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.61 -46.46 85.64 Favored 'General case' 0 C--O 1.222 -0.389 0 C-N-CA 124.23 1.012 . . . . 0.0 108.721 179.119 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 44' ' ' TYR . . . . . . . . . . . . . 82.7 t80 -55.07 -52.98 61.52 Favored 'General case' 0 N--CA 1.447 -0.576 0 C-N-CA 124.399 1.08 . . . . 0.0 109.081 179.426 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 45' ' ' ILE . . . . . . . . . . . . . 11.0 mm -55.89 -62.25 0.89 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.25 0 C-N-CA 124.688 1.195 . . . . 0.0 111.504 179.781 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 46' ' ' ARG . . . . . . . . . . . . . 22.4 ptt180 -58.67 -39.27 80.15 Favored 'General case' 0 N--CA 1.454 -0.262 0 CA-C-O 117.809 -1.091 . . . . 0.0 112.847 -177.69 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 47' ' ' ASN . . . . . . . . . . . . . 29.2 t30 -65.12 -56.01 15.44 Favored 'General case' 0 C--N 1.332 -0.162 0 C-N-CA 124.255 1.022 . . . . 0.0 109.409 179.212 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -56.9 -29.27 62.86 Favored 'General case' 0 N--CA 1.454 -0.274 0 C-N-CA 124.453 1.101 . . . . 0.0 112.055 -179.385 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 49' ' ' ALA . . . . . . . . . . . . . . . -75.08 -25.6 58.69 Favored 'General case' 0 N--CA 1.445 -0.714 0 N-CA-C 113.748 1.018 . . . . 0.0 113.748 179.982 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 10.7 mt -93.72 -44.79 7.98 Favored 'General case' 0 C--O 1.238 0.461 0 C-N-CA 123.373 0.669 . . . . 0.0 109.226 -179.847 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 51' ' ' ASN . . . . . . . . . . . . . 73.0 m-20 . . . . . 0 C--O 1.251 1.132 0 C-N-CA 125.558 1.543 . . . . 0.0 109.99 -179.751 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 10.8 m . . . . . 0 CA--C 1.511 -0.534 0 N-CA-C 107.624 -1.25 . . . . 0.0 107.624 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -77.31 81.32 3.8 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 105.892 -1.892 . . . . 0.0 105.892 179.828 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 60.7 m -114.32 123.33 49.25 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 124.48 1.112 . . . . 0.0 110.253 -178.664 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -144.28 141.78 30.02 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 123.551 0.74 . . . . 0.0 110.396 -179.818 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 34.5 m -140.12 155.97 24.39 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.309 0 C-N-CA 124.329 1.052 . . . . 0.0 108.953 179.392 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 27.7 mmt85 -137.43 22.52 2.95 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 125.496 1.519 . . . . 0.0 107.579 177.404 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 15.8 mmtp -65.47 164.04 14.69 Favored 'General case' 0 C--O 1.238 0.461 0 CA-C-O 121.831 0.824 . . . . 0.0 108.933 179.651 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 41.0 mtmt -135.14 161.33 35.65 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 106.159 -1.793 . . . . 0.0 106.159 179.287 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 22.5 p -139.47 -1.64 1.67 Allowed 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 112.328 0.492 . . . . 0.0 112.328 -179.615 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . 0.416 ' HB2' HH11 ' A' ' 12' ' ' ARG . 1.8 pm0 -91.98 148.21 22.37 Favored 'General case' 0 N--CA 1.45 -0.437 0 O-C-N 121.647 -0.658 . . . . 0.0 109.742 179.563 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 8.3 p -157.78 -20.96 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.538 0.513 0 C-N-CA 124.584 1.153 . . . . 0.0 111.765 -179.588 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . 0.416 HH11 ' HB2' ' A' ' 10' ' ' GLU . 0.1 OUTLIER 49.14 42.26 21.01 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 125.537 1.535 . . . . 0.0 112.176 -179.301 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 6.6 tt0 -113.27 117.49 31.99 Favored 'General case' 0 C--N 1.33 -0.251 0 C-N-CA 125.263 1.425 . . . . 0.0 107.589 179.564 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 21.1 pttm -84.56 -31.65 24.24 Favored 'General case' 0 CA--C 1.535 0.381 0 N-CA-C 109.434 -0.58 . . . . 0.0 109.434 177.97 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 2.8 t -80.19 -174.06 4.32 Favored 'General case' 0 N--CA 1.446 -0.673 0 C-N-CA 125.322 1.449 . . . . 0.0 108.253 179.546 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 6.2 t -132.48 148.74 31.78 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.657 0 N-CA-C 105.65 -1.982 . . . . 0.0 105.65 178.963 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 14.8 p -139.1 112.96 6.92 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.038 0 N-CA-C 105.815 -1.92 . . . . 0.0 105.815 178.02 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 17.7 ttt180 -140.93 178.81 7.1 Favored 'General case' 0 C--O 1.236 0.388 0 N-CA-C 107.549 -1.278 . . . . 0.0 107.549 -179.635 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 6.4 m -116.77 108.03 15.38 Favored 'General case' 0 C--O 1.237 0.414 0 N-CA-C 106.91 -1.515 . . . . 0.0 106.91 179.765 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -96.49 99.77 11.41 Favored 'General case' 0 C--O 1.235 0.308 0 N-CA-C 108.435 -0.95 . . . . 0.0 108.435 -178.94 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 1.2 mmt-85 -81.65 154.9 25.88 Favored 'General case' 0 C--O 1.235 0.316 0 C-N-CA 123.36 0.664 . . . . 0.0 109.484 179.094 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 96.9 m-85 -148.05 152.84 38.07 Favored 'General case' 0 CA--C 1.516 -0.344 0 C-N-CA 124.206 1.002 . . . . 0.0 108.644 178.633 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 14.5 m -79.49 167.04 37.25 Favored Pre-proline 0 CA--C 1.545 0.76 0 N-CA-C 107.496 -1.298 . . . . 0.0 107.496 178.603 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 34.5 Cg_endo -63.38 -43.01 19.41 Favored 'Trans proline' 0 N--CA 1.461 -0.418 0 C-N-CA 121.515 1.477 . . . . 0.0 112.025 -178.713 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 60.7 t -66.49 -39.36 83.81 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.557 0 C-N-CA 124.198 0.999 . . . . 0.0 109.921 179.795 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 97.5 mt-10 -63.7 -41.45 98.12 Favored 'General case' 0 N--CA 1.465 0.279 0 O-C-N 121.209 -0.932 . . . . 0.0 109.731 179.707 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -68.19 -47.51 67.74 Favored 'General case' 0 C--O 1.218 -0.595 0 C-N-CA 124.445 1.098 . . . . 0.0 110.719 179.442 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -58.01 -34.26 69.83 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 118.692 0.678 . . . . 0.0 109.268 178.794 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 39.5 m -70.88 -60.71 2.09 Favored 'General case' 0 N--CA 1.45 -0.433 0 O-C-N 121.795 -0.566 . . . . 0.0 109.614 179.309 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 51.0 mt -58.73 -42.6 85.74 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.295 0 C-N-CA 123.765 0.826 . . . . 0.0 111.814 -178.247 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 59.7 ttt180 -64.27 -44.83 90.5 Favored 'General case' 0 N--CA 1.448 -0.538 0 CA-C-O 117.336 -1.316 . . . . 0.0 110.539 -179.481 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 2.1 mptp? -68.03 -44.73 75.8 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-N 119.863 1.211 . . . . 0.0 109.282 179.536 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 37.0 mmtt -55.93 -49.17 74.24 Favored 'General case' 0 CA--C 1.518 -0.253 0 C-N-CA 123.686 0.795 . . . . 0.0 110.609 -179.779 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -59.41 -53.8 54.05 Favored 'General case' 0 N--CA 1.444 -0.76 0 C-N-CA 125.419 1.487 . . . . 0.0 110.264 179.897 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 25.7 tt0 -57.76 -41.26 81.58 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 123.761 0.824 . . . . 0.0 110.805 -179.498 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 29.2 t70 -68.34 -40.24 81.61 Favored 'General case' 0 N--CA 1.463 0.201 0 C-N-CA 125.452 1.501 . . . . 0.0 109.95 179.663 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 22.5 t -73.06 -15.39 61.51 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 123.817 0.847 . . . . 0.0 109.647 178.356 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 75.21 0.82 62.34 Favored Glycine 0 CA--C 1.533 1.207 0 O-C-N 120.817 -1.177 . . . . 0.0 110.161 -178.189 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 40.7 mt -96.53 114.41 26.07 Favored 'General case' 0 N--CA 1.449 -0.49 0 N-CA-C 104.713 -2.329 . . . . 0.0 104.713 179.543 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 4.3 t -51.66 153.78 2.23 Favored 'General case' 0 CA--C 1.539 0.531 0 N-CA-C 109.475 -0.565 . . . . 0.0 109.475 179.336 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 55.8 t -44.88 -42.79 2.48 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.124 0 C-N-CA 124.964 1.306 . . . . 0.0 112.205 -178.805 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 1.6 p -63.22 -45.54 91.17 Favored 'General case' 0 CA--C 1.536 0.416 0 CA-C-N 119.034 0.834 . . . . 0.0 112.032 179.859 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -65.97 -45.37 81.93 Favored 'General case' 0 C--O 1.222 -0.38 0 C-N-CA 123.7 0.8 . . . . 0.0 109.083 178.777 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 65.1 t80 -56.07 -52.04 65.69 Favored 'General case' 0 N--CA 1.452 -0.361 0 C-N-CA 124.702 1.201 . . . . 0.0 109.11 179.888 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 3.9 mm -54.79 -62.66 0.7 Allowed 'Isoleucine or valine' 0 N--CA 1.457 -0.087 0 C-N-CA 124.91 1.284 . . . . 0.0 110.588 179.782 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 14.5 ptt180 -58.36 -46.66 85.87 Favored 'General case' 0 C--O 1.222 -0.369 0 CA-C-O 118.311 -0.852 . . . . 0.0 111.368 -178.195 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 22.0 t30 -56.66 -54.57 44.52 Favored 'General case' 0 C--O 1.225 -0.205 0 CA-C-N 119.181 0.901 . . . . 0.0 110.251 -179.748 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -60.25 -33.78 72.78 Favored 'General case' 0 N--CA 1.452 -0.337 0 N-CA-C 112.409 0.522 . . . . 0.0 112.409 -179.45 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -72.24 -40.89 67.39 Favored 'General case' 0 C--O 1.232 0.182 0 N-CA-C 113.049 0.759 . . . . 0.0 113.049 -179.154 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 14.7 mt -85.04 -37.03 20.83 Favored 'General case' 0 C--N 1.331 -0.232 0 C-N-CA 124.334 1.054 . . . . 0.0 113.295 -177.938 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 72.6 m-80 . . . . . 0 C--O 1.259 1.595 0 N-CA-C 113.684 0.994 . . . . 0.0 113.684 -177.095 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 1' ' ' SER . . . . . . . . . . . . . 6.3 m . . . . . 0 CA--C 1.511 -0.542 0 N-CA-C 107.483 -1.303 . . . . 0.0 107.483 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 2' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -84.23 49.6 1.69 Allowed 'General case' 0 C--N 1.324 -0.526 0 C-N-CA 126.477 1.911 . . . . 0.0 108.279 -179.073 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 3' ' ' SER . . . . . . . . . . . . . 13.8 m -69.04 134.76 49.86 Favored 'General case' 0 N--CA 1.443 -0.808 0 C-N-CA 127.681 2.393 . . . . 0.0 109.196 -179.426 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 4' ' ' ALA . . . . . . . . . . . . . . . -140.79 114.51 8.91 Favored 'General case' 0 N--CA 1.452 -0.358 0 N-CA-C 108.6 -0.889 . . . . 0.0 108.6 -179.884 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 20.9 m -129.08 141.58 46.25 Favored 'Isoleucine or valine' 0 C--O 1.234 0.243 0 C-N-CA 124.935 1.294 . . . . 0.0 107.878 179.372 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 6' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -134.21 41.36 2.97 Favored 'General case' 0 C--O 1.236 0.392 0 C-N-CA 125.58 1.552 . . . . 0.0 110.972 -179.798 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 6.0 mptp? -77.96 -177.49 5.01 Favored 'General case' 0 C--N 1.327 -0.393 0 C-N-CA 125.468 1.507 . . . . 0.0 108.409 178.87 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 2.1 mtmm -149.17 166.28 29.3 Favored 'General case' 0 C--O 1.239 0.527 0 C-N-CA 127.797 2.439 . . . . 0.0 105.843 178.328 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 14.1 p -143.34 -13.39 0.7 Allowed 'General case' 0 C--N 1.33 -0.254 0 N-CA-C 114.825 1.417 . . . . 0.0 114.825 -178.95 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 10' ' ' GLU . . . . . . . . . . . . . 1.2 pm0 -81.63 94.95 7.04 Favored 'General case' 0 N--CA 1.456 -0.155 0 C-N-CA 125.798 1.639 . . . . 0.0 110.985 -179.3 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 11' ' ' VAL . . . . . . . . . . . . . 19.6 m -93.72 -11.89 8.94 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.439 0 O-C-N 121.327 -0.858 . . . . 0.0 112.662 179.769 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 12' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER 43.89 58.33 3.67 Favored 'General case' 0 N--CA 1.469 0.496 0 C-N-CA 125.272 1.429 . . . . 0.0 111.627 -179.63 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 13' ' ' GLN . . . . . . . . . . . . . 12.9 tt0 -140.43 115.75 9.95 Favored 'General case' 0 C--O 1.235 0.327 0 C-N-CA 125.114 1.366 . . . . 0.0 109.258 -179.234 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 23.5 pttm -80.15 -42.47 23.38 Favored 'General case' 0 N--CA 1.462 0.147 0 N-CA-C 109.254 -0.647 . . . . 0.0 109.254 178.748 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 10.5 t -69.13 178.51 2.26 Favored 'General case' 0 N--CA 1.449 -0.486 0 C-N-CA 124.597 1.159 . . . . 0.0 108.302 179.169 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 5.6 t -125.43 145.62 32.49 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.588 0 N-CA-C 106.518 -1.66 . . . . 0.0 106.518 179.575 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 9.4 p -137.82 119.1 17.43 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.365 0 N-CA-C 108.46 -0.941 . . . . 0.0 108.46 -179.932 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 17.8 ttt180 -149.43 157.9 43.7 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-O 120.519 0.2 . . . . 0.0 110.814 179.073 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 1.6 m -94.96 93.84 7.65 Favored 'General case' 0 N--CA 1.451 -0.413 0 C-N-CA 125.28 1.432 . . . . 0.0 107.917 179.934 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -95.49 94.8 8.0 Favored 'General case' 0 C--N 1.327 -0.409 0 C-N-CA 124.574 1.15 . . . . 0.0 108.869 -179.654 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 20.5 mmm-85 -76.47 147.68 37.71 Favored 'General case' 0 C--O 1.239 0.514 0 N-CA-C 108.799 -0.815 . . . . 0.0 108.799 179.273 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 22' ' ' PHE . . . . . . . . . . . . . 92.3 m-85 -136.0 153.46 51.37 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 124.674 1.19 . . . . 0.0 108.796 179.541 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 18.7 m -82.04 168.7 22.09 Favored Pre-proline 0 CA--C 1.541 0.614 0 C-N-CA 124.313 1.045 . . . . 0.0 109.74 179.232 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 24' ' ' PRO . . . . . . . . . . . . . 33.0 Cg_endo -64.36 -36.58 44.27 Favored 'Trans proline' 0 C--N 1.349 0.582 0 C-N-CA 121.658 1.572 . . . . 0.0 111.205 -179.391 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 25' ' ' VAL . . . . . . . . . . . . . 86.0 t -66.34 -45.54 89.27 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.211 0 N-CA-C 108.35 -0.981 . . . . 0.0 108.35 179.02 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 96.7 mt-10 -60.9 -49.58 76.88 Favored 'General case' 0 N--CA 1.455 -0.21 0 C-N-CA 123.62 0.768 . . . . 0.0 110.856 -179.319 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 27' ' ' ASP . . . . . . . . . . . . . 33.6 t70 -60.31 -53.27 59.65 Favored 'General case' 0 CA--C 1.502 -0.871 0 CA-C-O 117.401 -1.285 . . . . 0.0 111.751 -179.365 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 28' ' ' GLU . . . . . . . . . . . . . 24.2 mm-40 -57.53 -44.37 85.06 Favored 'General case' 0 N--CA 1.454 -0.258 0 CA-C-N 118.855 0.752 . . . . 0.0 109.012 -179.442 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 30.6 m -58.15 -53.05 62.65 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-N 118.536 0.607 . . . . 0.0 110.45 179.966 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 57.7 mt -61.74 -44.48 98.83 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.269 0 C-N-CA 124.323 1.049 . . . . 0.0 110.831 -179.414 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 24.7 ttt180 -62.62 -46.34 88.7 Favored 'General case' 0 C--N 1.325 -0.486 0 C-N-CA 126.204 1.801 . . . . 0.0 111.32 -178.902 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 4.7 mptp? -66.78 -42.84 85.41 Favored 'General case' 0 CA--C 1.518 -0.253 0 N-CA-C 108.9 -0.778 . . . . 0.0 108.9 -179.561 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 39.3 mmtt -63.15 -53.34 54.91 Favored 'General case' 0 C--O 1.222 -0.389 0 C-N-CA 123.496 0.718 . . . . 0.0 109.93 179.219 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 34' ' ' ALA . . . . . . . . . . . . . . . -52.51 -50.6 62.47 Favored 'General case' 0 C--O 1.236 0.359 0 C-N-CA 124.836 1.254 . . . . 0.0 111.394 -178.826 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -63.76 -39.95 95.51 Favored 'General case' 0 CA--C 1.532 0.258 0 CA-C-O 119.195 -0.431 . . . . 0.0 111.822 -179.573 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 36' ' ' ASP . . . . . . . . . . . . . 37.6 t70 -75.08 -30.73 61.02 Favored 'General case' 0 N--CA 1.465 0.317 0 C-N-CA 123.959 0.904 . . . . 0.0 112.931 -178.285 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 37' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -86.99 -6.13 58.86 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-O 118.156 -0.926 . . . . 0.0 112.459 -179.488 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 75.89 14.35 82.26 Favored Glycine 0 CA--C 1.534 1.262 0 CA-C-N 119.87 1.214 . . . . 0.0 114.172 179.348 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 39' ' ' LEU . . . . . . . . . . . . . 20.9 mt -121.68 112.27 18.22 Favored 'General case' 0 CA--C 1.517 -0.316 0 N-CA-C 105.828 -1.916 . . . . 0.0 105.828 179.623 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 40' ' ' THR . . . . . . . . . . . . . 14.1 t -52.05 156.11 1.67 Allowed 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 124.702 1.201 . . . . 0.0 109.561 179.163 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 41' ' ' VAL . . . . . . . . . . . . . 78.2 t -44.62 -47.39 2.61 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.232 0 C-N-CA 125.216 1.406 . . . . 0.0 112.566 -177.951 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 42' ' ' SER . . . . . . . . . . . . . 14.1 m -63.15 -47.45 82.63 Favored 'General case' 0 CA--C 1.543 0.696 0 CA-C-N 118.792 0.724 . . . . 0.0 111.523 -179.432 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -65.04 -43.3 92.84 Favored 'General case' 0 C--O 1.22 -0.476 0 C-N-CA 124.475 1.11 . . . . 0.0 109.788 178.644 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 44' ' ' TYR . . . . . . . . . . . . . 80.8 t80 -53.79 -53.72 48.35 Favored 'General case' 0 N--CA 1.455 -0.183 0 C-N-CA 125.515 1.526 . . . . 0.0 108.551 179.447 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 45' ' ' ILE . . . . . . . . . . . . . 18.5 mm -54.7 -61.21 1.07 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.226 0 C-N-CA 123.948 0.899 . . . . 0.0 111.202 179.595 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 46' ' ' ARG . . . . . . . . . . . . . 29.0 ptt180 -57.7 -45.23 85.98 Favored 'General case' 0 N--CA 1.466 0.374 0 O-C-N 121.975 -0.453 . . . . 0.0 111.345 -178.324 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 47' ' ' ASN . . . . . . . . . . . . . 35.2 t30 -57.91 -55.63 32.39 Favored 'General case' 0 N--CA 1.449 -0.504 0 C-N-CA 123.697 0.799 . . . . 0.0 111.436 -179.389 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -62.29 -32.01 72.68 Favored 'General case' 0 CA--C 1.529 0.171 0 C-N-CA 124.313 1.045 . . . . 0.0 112.385 -179.656 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 49' ' ' ALA . . . . . . . . . . . . . . . -77.14 -40.91 43.88 Favored 'General case' 0 N--CA 1.451 -0.394 0 N-CA-C 113.195 0.813 . . . . 0.0 113.195 -178.75 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 22.8 mt -74.18 -43.18 58.28 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 118.467 0.576 . . . . 0.0 111.685 -178.919 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 51' ' ' ASN . . . . . . . . . . . . . 53.3 m-80 . . . . . 0 C--O 1.254 1.326 0 CA-C-O 117.951 -1.023 . . . . 0.0 110.927 -179.785 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 10.2 m . . . . . 0 CA--C 1.514 -0.435 0 N-CA-C 107.33 -1.359 . . . . 0.0 107.33 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 4.4 p-10 -144.16 -149.76 0.29 Allowed 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 126.592 1.957 . . . . 0.0 106.381 -179.412 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 23.4 m -147.48 17.03 1.16 Allowed 'General case' 0 CA--C 1.539 0.529 0 CA-C-N 120.672 1.578 . . . . 0.0 113.089 179.895 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -59.55 -18.48 41.01 Favored 'General case' 0 CA--C 1.53 0.199 0 C-N-CA 124.384 1.074 . . . . 0.0 113.655 -179.543 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 14.1 p -52.31 -26.91 9.78 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.661 0 C-N-CA 124.806 1.242 . . . . 0.0 111.849 179.341 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 31.2 ptt85 -69.28 -0.84 6.76 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 124.552 1.141 . . . . 0.0 113.796 179.309 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 15.9 pttp -143.01 120.88 11.96 Favored 'General case' 0 C--O 1.227 -0.081 0 CA-C-N 119.909 1.232 . . . . 0.0 110.067 -179.86 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 50.8 mtmt -92.6 1.77 57.07 Favored 'General case' 0 N--CA 1.469 0.512 0 O-C-N 121.405 -0.81 . . . . 0.0 110.671 178.586 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 16.4 p -149.7 -179.95 7.52 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 127.111 2.165 . . . . 0.0 109.26 -179.482 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 39.2 mt-10 -134.02 173.27 11.75 Favored 'General case' 0 CA--C 1.528 0.117 0 C-N-CA 124.399 1.08 . . . . 0.0 111.053 -178.961 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 3.0 m -124.31 102.02 10.11 Favored 'Isoleucine or valine' 0 C--O 1.234 0.264 0 N-CA-C 106.104 -1.813 . . . . 0.0 106.104 178.945 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 14.5 ptp180 -164.17 123.97 2.03 Favored 'General case' 0 C--O 1.236 0.36 0 C-N-CA 127.518 2.327 . . . . 0.0 105.269 179.449 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 59.5 mt-30 -105.41 87.45 2.62 Favored 'General case' 0 N--CA 1.443 -0.799 0 N-CA-C 105.396 -2.076 . . . . 0.0 105.396 -178.695 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 5.7 ptpt -58.31 -22.81 54.46 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-N 114.612 -1.177 . . . . 0.0 112.841 179.933 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 4.8 t -84.74 160.99 20.18 Favored 'General case' 0 N--CA 1.447 -0.62 0 N-CA-C 109.333 -0.618 . . . . 0.0 109.333 178.774 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 9.3 t -109.96 84.5 0.73 Allowed 'Isoleucine or valine' 0 CA--C 1.513 -0.448 0 N-CA-C 109.765 -0.457 . . . . 0.0 109.765 -179.663 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 11.8 p -83.24 121.01 35.55 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.498 0 N-CA-C 105.502 -2.036 . . . . 0.0 105.502 178.107 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 13.0 ttt85 -157.07 163.21 39.26 Favored 'General case' 0 C--O 1.236 0.39 0 N-CA-C 107.79 -1.189 . . . . 0.0 107.79 179.042 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 2.2 m -102.14 130.71 48.84 Favored 'General case' 0 C--N 1.327 -0.413 0 N-CA-C 106.716 -1.587 . . . . 0.0 106.716 179.698 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -130.43 125.87 35.55 Favored 'General case' 0 N--CA 1.448 -0.533 0 N-CA-C 107.005 -1.48 . . . . 0.0 107.005 179.171 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 15.2 mtp180 -107.21 155.55 19.79 Favored 'General case' 0 N--CA 1.455 -0.219 0 C-N-CA 124.306 1.042 . . . . 0.0 111.136 179.666 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 35.5 m-85 -133.73 -171.41 2.71 Favored 'General case' 0 C--O 1.236 0.365 0 C-N-CA 125.567 1.547 . . . . 0.0 108.512 179.787 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 1.2 m -118.18 175.75 1.95 Allowed Pre-proline 0 CA--C 1.539 0.542 0 CA-C-O 117.218 -1.373 . . . . 0.0 107.668 179.433 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_endo -65.0 -51.06 1.77 Allowed 'Trans proline' 0 N--CA 1.458 -0.574 0 CA-C-N 121.458 1.556 . . . . 0.0 111.869 -178.368 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 57.9 t -59.46 -44.3 92.48 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.268 0 C-N-CA 124.713 1.205 . . . . 0.0 111.002 -179.823 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 3.9 mm-40 -65.8 -48.19 72.57 Favored 'General case' 0 C--N 1.331 -0.201 0 C-N-CA 123.852 0.861 . . . . 0.0 110.351 -178.572 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 7.6 t70 -61.42 -43.5 98.77 Favored 'General case' 0 CA--C 1.514 -0.431 0 C-N-CA 124.176 0.99 . . . . 0.0 110.865 179.641 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 45.6 tt0 -61.85 -48.76 79.1 Favored 'General case' 0 N--CA 1.448 -0.554 0 C-N-CA 125.035 1.334 . . . . 0.0 108.568 179.697 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 79.8 m -56.79 -51.72 67.83 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 123.378 0.671 . . . . 0.0 109.222 179.185 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 82.3 mt -62.86 -41.66 93.46 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.41 0 C-N-CA 123.592 0.757 . . . . 0.0 110.296 -179.372 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 14.9 ttt180 -62.44 -52.22 64.39 Favored 'General case' 0 CA--C 1.517 -0.291 0 O-C-N 121.042 -1.036 . . . . 0.0 110.083 -179.928 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 5.0 mptp? -57.69 -47.85 81.2 Favored 'General case' 0 N--CA 1.452 -0.33 0 CA-C-O 118.626 -0.702 . . . . 0.0 109.348 -179.113 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 50.4 mttp -68.46 -35.12 77.11 Favored 'General case' 0 C--O 1.223 -0.29 0 CA-C-O 117.871 -1.061 . . . . 0.0 111.952 -179.173 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -60.81 -52.44 65.08 Favored 'General case' 0 C--N 1.332 -0.162 0 N-CA-C 106.845 -1.539 . . . . 0.0 106.845 177.844 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 8.5 tt0 -62.39 -38.96 91.64 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-N 115.856 -0.611 . . . . 0.0 111.728 -179.389 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 49.6 t0 -66.02 -42.68 89.31 Favored 'General case' 0 N--CA 1.466 0.355 0 N-CA-C 107.959 -1.126 . . . . 0.0 107.959 179.022 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 20.8 t -61.6 -33.27 73.62 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 125.488 1.515 . . . . 0.0 108.102 178.885 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 91.27 38.23 6.02 Favored Glycine 0 N--CA 1.447 -0.583 0 N-CA-C 107.776 -2.13 . . . . 0.0 107.776 -179.032 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 69.1 mt -138.56 159.31 42.42 Favored 'General case' 0 N--CA 1.447 -0.592 0 C-N-CA 126.596 1.958 . . . . 0.0 108.92 -179.17 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 1.7 t -82.37 154.81 25.05 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 104.698 -2.334 . . . . 0.0 104.698 176.906 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 37.4 t -44.93 -42.78 2.51 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.428 0 C-N-CA 126.466 1.907 . . . . 0.0 110.598 178.796 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 6.7 p -58.74 -51.86 68.17 Favored 'General case' 0 CA--C 1.531 0.244 0 CA-C-N 119.66 1.118 . . . . 0.0 111.644 179.52 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -61.15 -47.78 84.64 Favored 'General case' 0 N--CA 1.455 -0.196 0 C-N-CA 124.728 1.211 . . . . 0.0 109.731 179.195 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 77.3 t80 -55.32 -47.17 76.05 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 124.369 1.068 . . . . 0.0 109.5 179.581 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 3.0 mm -57.42 -66.53 0.32 Allowed 'Isoleucine or valine' 0 C--O 1.225 -0.225 0 C-N-CA 125.267 1.427 . . . . 0.0 110.03 179.327 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 9.2 ptm180 -54.37 -40.98 68.64 Favored 'General case' 0 C--O 1.22 -0.472 0 CA-C-O 118.001 -1.0 . . . . 0.0 112.914 -178.501 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 34.9 t30 -68.97 -45.12 71.47 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 119.642 1.11 . . . . 0.0 112.4 -179.339 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -64.76 -33.4 75.9 Favored 'General case' 0 C--O 1.224 -0.288 0 CA-C-N 118.468 0.576 . . . . 0.0 109.943 178.869 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -72.84 -14.25 61.46 Favored 'General case' 0 N--CA 1.453 -0.305 0 C-N-CA 124.199 0.999 . . . . 0.0 112.99 -179.375 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 20.7 mt -100.47 -40.88 7.23 Favored 'General case' 0 CA--C 1.509 -0.626 0 CA-C-O 118.277 -0.868 . . . . 0.0 109.9 178.826 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 70.0 m-80 . . . . . 0 C--O 1.251 1.178 0 O-C-N 124.455 1.097 . . . . 0.0 110.687 179.519 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 1' ' ' SER . . . . . . . . . . . . . 13.0 m . . . . . 0 CA--C 1.515 -0.38 0 N-CA-C 107.39 -1.337 . . . . 0.0 107.39 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 2' ' ' ASP . . . . . . . . . . . . . 6.4 p-10 -149.26 -153.92 0.52 Allowed 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 126.745 2.018 . . . . 0.0 107.076 -178.833 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 3' ' ' SER . . . . . . . . . . . . . 19.4 m -145.09 13.74 1.45 Allowed 'General case' 0 CA--C 1.541 0.606 0 CA-C-N 120.076 1.307 . . . . 0.0 113.489 179.947 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 4' ' ' ALA . . . . . . . . . . . . . . . -58.44 -22.79 55.6 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 124.871 1.268 . . . . 0.0 112.105 179.806 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 14.5 p -53.71 -20.88 4.1 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.555 0 C-N-CA 126.437 1.895 . . . . 0.0 112.337 179.323 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 6' ' ' ARG . . . . . . . . . . . . . 52.7 ptt85 -59.74 -15.8 22.7 Favored 'General case' 0 CA--C 1.535 0.383 0 O-C-N 120.931 -1.106 . . . . 0.0 113.172 179.171 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 16.9 pttp -143.75 158.59 43.57 Favored 'General case' 0 CA--C 1.528 0.1 0 C-N-CA 126.137 1.775 . . . . 0.0 107.508 -179.647 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 21.3 mtmt -112.27 4.7 17.91 Favored 'General case' 0 N--CA 1.465 0.32 0 C-N-CA 123.686 0.794 . . . . 0.0 112.906 -179.113 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 17.0 p -155.87 163.23 40.04 Favored 'General case' 0 C--O 1.238 0.489 0 C-N-CA 124.972 1.309 . . . . 0.0 108.668 179.32 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 10' ' ' GLU . . . . . . . . . . . . . 34.7 mt-10 -101.18 -175.53 2.89 Favored 'General case' 0 C--O 1.243 0.744 0 C-N-CA 125.261 1.424 . . . . 0.0 110.1 179.421 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 11' ' ' VAL . . . . . . . . . . . . . 16.3 t -137.49 91.54 0.81 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.549 0 C-N-CA 126.091 1.756 . . . . 0.0 107.967 -179.872 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 12' ' ' ARG . . . . . . . . . . . . . 17.2 mtp180 -138.73 169.0 18.59 Favored 'General case' 0 N--CA 1.468 0.43 0 C-N-CA 125.592 1.557 . . . . 0.0 109.426 179.331 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 13' ' ' GLN . . . . . . . . . . . . . 47.9 mt-30 -133.38 91.41 2.86 Favored 'General case' 0 N--CA 1.451 -0.383 0 C-N-CA 125.681 1.593 . . . . 0.0 107.019 179.111 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 20.9 ptmt -67.52 -17.74 64.78 Favored 'General case' 0 CA--C 1.536 0.421 0 N-CA-C 112.97 0.73 . . . . 0.0 112.97 179.305 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 10.9 t -92.46 -173.51 3.41 Favored 'General case' 0 N--CA 1.45 -0.458 0 C-N-CA 125.497 1.519 . . . . 0.0 108.435 178.522 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 2.8 t -136.12 88.9 0.75 Allowed 'Isoleucine or valine' 0 N--CA 1.447 -0.594 0 N-CA-C 106.948 -1.501 . . . . 0.0 106.948 -179.593 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 8.3 p -85.5 103.7 12.68 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.447 0 N-CA-C 104.751 -2.314 . . . . 0.0 104.751 178.689 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 36.1 ttt85 -137.66 165.57 26.06 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 108.376 -0.972 . . . . 0.0 108.376 -179.669 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 35.1 m -112.67 120.66 42.31 Favored 'General case' 0 N--CA 1.449 -0.483 0 N-CA-C 105.275 -2.12 . . . . 0.0 105.275 179.696 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -118.75 111.71 18.82 Favored 'General case' 0 CA--C 1.517 -0.317 0 C-N-CA 123.699 0.799 . . . . 0.0 109.686 -178.242 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 62.0 mtm180 -90.08 153.91 20.19 Favored 'General case' 0 N--CA 1.454 -0.259 0 CA-C-O 121.225 0.536 . . . . 0.0 111.283 179.362 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 22' ' ' PHE . . . . . . . . . . . . . 63.9 m-85 -139.33 162.36 35.19 Favored 'General case' 0 C--O 1.235 0.298 0 C-N-CA 126.833 2.053 . . . . 0.0 107.256 -179.588 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -94.86 177.82 1.7 Allowed Pre-proline 0 CA--C 1.546 0.824 0 N-CA-C 108.463 -0.939 . . . . 0.0 108.463 179.069 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 24' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -71.32 -23.47 24.03 Favored 'Trans proline' 0 N--CA 1.461 -0.402 0 C-N-CA 121.583 1.522 . . . . 0.0 114.458 -177.843 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 25' ' ' VAL . . . . . . . . . . . . . 98.6 t -75.35 -45.7 39.93 Favored 'Isoleucine or valine' 0 C--O 1.235 0.327 0 N-CA-C 107.608 -1.256 . . . . 0.0 107.608 179.823 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -63.67 -40.81 97.77 Favored 'General case' 0 N--CA 1.451 -0.419 0 CA-C-O 119.207 -0.425 . . . . 0.0 110.398 179.22 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 27' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -62.43 -48.08 81.23 Favored 'General case' 0 CA--C 1.51 -0.564 0 C-N-CA 123.289 0.635 . . . . 0.0 111.494 -179.702 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 28' ' ' GLU . . . . . . . . . . . . . 29.3 tt0 -60.34 -49.28 78.22 Favored 'General case' 0 N--CA 1.449 -0.524 0 N-CA-C 108.679 -0.859 . . . . 0.0 108.679 179.15 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 49.6 m -58.23 -57.21 13.89 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 122.701 0.4 . . . . 0.0 110.131 -179.818 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 55.4 mt -56.5 -47.23 82.12 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.272 0 C-N-CA 124.08 0.952 . . . . 0.0 110.888 -179.253 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 23.3 ttt-85 -62.23 -44.57 96.27 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 118.378 -0.82 . . . . 0.0 111.367 -178.922 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 1.7 mptm? -61.9 -50.89 70.37 Favored 'General case' 0 C--O 1.226 -0.167 0 CA-C-N 118.618 0.644 . . . . 0.0 109.406 179.4 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 4.6 mptp? -62.53 -42.69 99.69 Favored 'General case' 0 N--CA 1.466 0.354 0 C-N-CA 123.193 0.597 . . . . 0.0 111.57 -179.023 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 34' ' ' ALA . . . . . . . . . . . . . . . -58.6 -53.06 62.59 Favored 'General case' 0 N--CA 1.451 -0.405 0 C-N-CA 123.645 0.778 . . . . 0.0 109.521 179.436 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 14.1 tt0 -62.35 -39.97 94.86 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-O 118.689 -0.672 . . . . 0.0 111.335 -178.037 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 36' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -60.59 -46.57 89.75 Favored 'General case' 0 CA--C 1.516 -0.34 0 C-N-CA 126.385 1.874 . . . . 0.0 108.33 179.099 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 37' ' ' SER . . . . . . . . . . . . . 6.3 t -73.22 -14.35 61.32 Favored 'General case' 0 N--CA 1.451 -0.399 0 C-N-CA 120.935 -0.306 . . . . 0.0 110.934 -179.686 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 81.92 2.97 90.71 Favored Glycine 0 CA--C 1.528 0.9 0 CA-C-O 118.713 -1.048 . . . . 0.0 111.71 -179.479 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 39' ' ' LEU . . . . . . . . . . . . . 64.0 mt -100.2 123.36 44.33 Favored 'General case' 0 N--CA 1.445 -0.698 0 C-N-CA 127.627 2.371 . . . . 0.0 106.269 -179.4 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 40' ' ' THR . . . . . . . . . . . . . 11.7 t -54.38 153.63 5.3 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 108.791 -0.818 . . . . 0.0 108.791 178.753 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 41' ' ' VAL . . . . . . . . . . . . . 56.1 t -47.6 -43.35 9.25 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.326 0 C-N-CA 124.768 1.227 . . . . 0.0 111.874 -179.21 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 42' ' ' SER . . . . . . . . . . . . . 2.1 p -61.26 -44.95 96.41 Favored 'General case' 0 CA--C 1.535 0.366 0 O-C-N 121.499 -0.751 . . . . 0.0 111.392 179.397 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -65.63 -44.29 86.89 Favored 'General case' 0 C--O 1.224 -0.271 0 C-N-CA 123.587 0.755 . . . . 0.0 108.98 178.692 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 44' ' ' TYR . . . . . . . . . . . . . 64.2 t80 -53.79 -50.5 65.95 Favored 'General case' 0 N--CA 1.454 -0.262 0 C-N-CA 124.654 1.182 . . . . 0.0 109.955 179.684 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 45' ' ' ILE . . . . . . . . . . . . . 10.0 mm -55.41 -62.48 0.79 Allowed 'Isoleucine or valine' 0 N--CA 1.463 0.196 0 C-N-CA 123.984 0.914 . . . . 0.0 111.41 179.853 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 46' ' ' ARG . . . . . . . . . . . . . 7.3 ptm180 -56.89 -40.64 76.61 Favored 'General case' 0 C--O 1.223 -0.342 0 CA-C-O 119.041 -0.504 . . . . 0.0 111.03 -179.045 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 47' ' ' ASN . . . . . . . . . . . . . 24.3 t30 -60.75 -55.38 33.89 Favored 'General case' 0 N--CA 1.449 -0.51 0 C-N-CA 123.677 0.791 . . . . 0.0 110.417 -179.583 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -61.46 -31.23 71.18 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 123.783 0.833 . . . . 0.0 112.382 -179.659 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 49' ' ' ALA . . . . . . . . . . . . . . . -75.27 -21.17 58.73 Favored 'General case' 0 N--CA 1.447 -0.595 0 N-CA-C 113.807 1.04 . . . . 0.0 113.807 -179.322 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 20.8 mt -101.12 -36.09 9.09 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-N 118.577 0.626 . . . . 0.0 110.468 -179.883 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 51' ' ' ASN . . . . . . . . . . . . . 58.0 m-80 . . . . . 0 C--O 1.246 0.898 0 CA-C-O 117.319 -1.324 . . . . 0.0 110.103 179.88 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 15.6 m . . . . . 0 N--CA 1.482 1.174 0 N-CA-C 107.074 -1.454 . . . . 0.0 107.074 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -85.87 172.84 10.42 Favored 'General case' 0 N--CA 1.439 -0.982 0 C-N-CA 131.641 3.976 . . . . 0.0 110.835 -176.682 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 27.2 m -163.26 178.52 8.11 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 125.759 1.624 . . . . 0.0 108.41 179.778 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -61.12 110.13 1.29 Allowed 'General case' 0 N--CA 1.451 -0.39 0 C-N-CA 123.413 0.685 . . . . 0.0 109.45 179.409 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 14.5 p -60.01 -18.73 16.27 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.647 0 C-N-CA 125.276 1.43 . . . . 0.0 112.35 179.45 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 8.9 ptp85 40.05 62.71 1.21 Allowed 'General case' 0 C--N 1.343 0.289 0 C-N-CA 127.683 2.393 . . . . 0.0 111.689 179.865 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 1.3 tmtp? -89.91 -23.23 21.66 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-O 118.012 -0.994 . . . . 0.0 112.786 -179.541 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 41.6 mttp -150.25 -69.07 0.19 Allowed 'General case' 0 N--CA 1.465 0.323 0 CA-C-N 119.715 1.143 . . . . 0.0 111.197 -179.635 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . 0.254 94.6 p 67.03 -11.31 0.27 Allowed 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 128.284 2.634 . . . . 0.0 113.487 -178.35 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 15.3 pt-20 -64.37 -4.07 3.51 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 126.826 2.05 . . . . 0.0 113.626 179.049 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 17.7 m -99.24 19.51 2.2 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.702 0 C-N-CA 127.756 2.423 . . . . 0.0 110.938 179.026 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 12.5 tpt180 -151.5 92.35 1.76 Allowed 'General case' 0 C--O 1.235 0.341 0 O-C-N 120.285 -1.509 . . . . 0.0 107.896 178.985 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 11.8 pt20 -72.53 94.15 1.66 Allowed 'General case' 0 N--CA 1.455 -0.201 0 N-CA-C 109.685 -0.487 . . . . 0.0 109.685 179.692 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -69.81 -24.29 63.46 Favored 'General case' 0 CA--C 1.532 0.259 0 O-C-N 121.959 -0.463 . . . . 0.0 111.154 179.132 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 3.4 t -80.05 -170.54 2.51 Favored 'General case' 0 N--CA 1.44 -0.925 0 CA-C-O 123.342 1.544 . . . . 0.0 109.153 179.173 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 3.1 t -142.08 143.37 26.67 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.881 0 N-CA-C 102.993 -2.966 . . . . 0.0 102.993 178.328 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 8.6 p -139.04 119.73 15.25 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.064 0 N-CA-C 106.409 -1.7 . . . . 0.0 106.409 178.77 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 52.6 ttm-85 -139.08 158.31 44.41 Favored 'General case' 0 CA--C 1.51 -0.568 0 CA-C-N 114.773 -1.103 . . . . 0.0 109.3 179.487 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 19.6 m -104.74 97.43 7.32 Favored 'General case' 0 N--CA 1.445 -0.68 0 N-CA-C 100.379 -3.934 . . . . 0.0 100.379 178.05 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 53.3 tp -109.9 92.29 3.99 Favored 'General case' 0 N--CA 1.448 -0.532 0 C-N-CA 125.964 1.706 . . . . 0.0 111.537 -178.038 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 8.3 mpt_? -66.78 156.08 36.47 Favored 'General case' 0 N--CA 1.44 -0.966 0 C-N-CA 123.94 0.896 . . . . 0.0 110.151 177.054 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 62.7 m-85 -131.48 147.53 52.56 Favored 'General case' 0 N--CA 1.466 0.355 0 N-CA-C 104.125 -2.546 . . . . 0.0 104.125 177.25 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 1.1 m -76.83 169.52 20.74 Favored Pre-proline 0 CA--C 1.545 0.757 0 N-CA-C 109.07 -0.715 . . . . 0.0 109.07 -179.004 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 59.5 Cg_endo -67.17 -32.25 34.27 Favored 'Trans proline' 0 C--N 1.345 0.377 0 C-N-CA 121.946 1.764 . . . . 0.0 113.584 -178.562 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 55.9 t -74.29 -49.31 32.83 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.174 0 N-CA-C 107.471 -1.307 . . . . 0.0 107.471 179.228 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 2.4 mp0 -56.24 -46.07 79.74 Favored 'General case' 0 N--CA 1.449 -0.514 0 C-N-CA 124.825 1.25 . . . . 0.0 108.976 179.578 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -62.26 -48.05 81.64 Favored 'General case' 0 CA--C 1.512 -0.51 0 C-N-CA 123.874 0.87 . . . . 0.0 111.999 179.58 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 39.7 tt0 -59.2 -48.4 81.75 Favored 'General case' 0 N--CA 1.452 -0.35 0 N-CA-C 108.896 -0.779 . . . . 0.0 108.896 -179.888 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 51.9 m -59.04 -55.18 38.45 Favored 'General case' 0 N--CA 1.455 -0.206 0 C-N-CA 123.585 0.754 . . . . 0.0 109.213 179.377 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 90.3 mt -58.5 -41.53 82.02 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.245 0 C-N-CA 123.327 0.651 . . . . 0.0 110.366 -179.176 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 54.5 ttt180 -60.62 -49.9 75.69 Favored 'General case' 0 N--CA 1.462 0.15 0 CA-C-N 119.301 0.955 . . . . 0.0 108.981 179.038 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 5.2 mptp? -58.16 -53.02 62.99 Favored 'General case' 0 C--O 1.225 -0.206 0 N-CA-C 109.077 -0.712 . . . . 0.0 109.077 179.578 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -59.99 -43.19 95.31 Favored 'General case' 0 CA--C 1.517 -0.304 0 C-N-CA 123.342 0.657 . . . . 0.0 112.173 -178.64 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -63.76 -48.63 76.17 Favored 'General case' 0 N--CA 1.446 -0.635 0 C-N-CA 124.441 1.096 . . . . 0.0 110.244 -179.787 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 27.7 tt0 -67.06 -32.92 74.43 Favored 'General case' 0 CA--C 1.533 0.297 0 O-C-N 121.364 -0.835 . . . . 0.0 110.877 179.891 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 8.1 t70 -70.17 -44.79 68.03 Favored 'General case' 0 CA--C 1.514 -0.437 0 C-N-CA 124.334 1.054 . . . . 0.0 108.857 -178.986 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 22.7 t -75.63 -9.8 58.9 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 124.78 1.232 . . . . 0.0 110.324 178.678 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 74.14 -6.89 18.91 Favored Glycine 0 CA--C 1.532 1.153 0 CA-C-O 118.845 -0.975 . . . . 0.0 111.014 -178.632 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 44.1 mt -88.41 119.17 28.59 Favored 'General case' 0 CA--C 1.513 -0.479 0 CA-C-N 119.89 1.845 . . . . 0.0 107.316 -179.429 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 5.2 t -48.37 151.36 1.08 Allowed 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 124.396 1.078 . . . . 0.0 109.768 178.884 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 41.6 t -46.72 -45.26 7.27 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.315 0 C-N-CA 125.018 1.327 . . . . 0.0 111.447 -178.762 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 54.3 m -61.2 -47.45 86.07 Favored 'General case' 0 CA--C 1.539 0.55 0 O-C-N 121.453 -0.78 . . . . 0.0 111.644 179.705 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -64.96 -44.16 90.29 Favored 'General case' 0 C--O 1.223 -0.317 0 C-N-CA 123.828 0.851 . . . . 0.0 109.36 178.787 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 80.8 t80 -55.12 -51.27 66.96 Favored 'General case' 0 N--CA 1.45 -0.471 0 C-N-CA 124.899 1.28 . . . . 0.0 109.837 179.725 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 12.1 mm -55.56 -65.86 0.33 Allowed 'Isoleucine or valine' 0 C--N 1.339 0.132 0 C-N-CA 124.897 1.279 . . . . 0.0 110.416 179.734 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 11.5 ptt180 -55.6 -44.94 77.45 Favored 'General case' 0 C--O 1.22 -0.452 0 CA-C-O 117.894 -1.05 . . . . 0.0 111.843 -178.241 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 30.8 t30 -58.35 -52.1 67.03 Favored 'General case' 0 CA--C 1.529 0.148 0 CA-C-N 119.322 0.964 . . . . 0.0 110.133 179.653 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -61.29 -30.84 70.73 Favored 'General case' 0 CA--C 1.533 0.316 0 N-CA-C 112.246 0.462 . . . . 0.0 112.246 179.749 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -82.37 -32.2 29.37 Favored 'General case' 0 C--O 1.222 -0.355 0 N-CA-C 114.817 1.414 . . . . 0.0 114.817 -178.969 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 22.1 mt -81.8 -41.58 20.92 Favored 'General case' 0 CA--C 1.508 -0.667 0 N-CA-C 113.944 1.09 . . . . 0.0 113.944 -177.551 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 69.5 m-80 . . . . . 0 C--O 1.251 1.141 0 CA-C-O 117.661 -1.162 . . . . 0.0 109.054 -178.896 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B ' 1' ' ' SER . . . . . . . . . . . . . 15.9 m . . . . . 0 N--CA 1.481 1.122 0 N-CA-C 106.959 -1.497 . . . . 0.0 106.959 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B ' 2' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -86.34 171.48 11.16 Favored 'General case' 0 N--CA 1.439 -1.003 1 C-N-CA 131.894 4.078 . . . . 0.0 109.953 -176.758 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 3' ' ' SER . . . . . . . . . . . . . 37.0 m -160.87 175.3 12.69 Favored 'General case' 0 C--O 1.234 0.271 0 C-N-CA 124.904 1.282 . . . . 0.0 108.872 179.87 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 4' ' ' ALA . . . . . . . . . . . . . . . -62.3 107.34 0.89 Allowed 'General case' 0 N--CA 1.452 -0.372 0 C-N-CA 124.075 0.95 . . . . 0.0 108.922 179.418 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 25.5 t -63.62 -26.15 40.02 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.473 0 C-N-CA 124.465 1.106 . . . . 0.0 111.697 -179.516 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 6' ' ' ARG . . . . . . . . . . . . . 85.3 mtt85 52.15 32.31 10.36 Favored 'General case' 0 N--CA 1.471 0.621 0 CA-C-N 119.705 1.138 . . . . 0.0 112.375 179.846 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 2.9 tmtt? -43.45 -23.65 0.07 Allowed 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 127.504 2.322 . . . . 0.0 115.571 -178.685 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 9.0 ptpp? -157.6 -35.88 0.07 Allowed 'General case' 0 C--N 1.332 -0.19 0 C-N-CA 125.111 1.364 . . . . 0.0 110.181 178.191 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 68.6 m 59.45 -21.33 0.03 OUTLIER 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 128.422 2.689 . . . . 0.0 116.735 179.547 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 10' ' ' GLU . . . . . . . . . . . . . 19.4 pt-20 -61.12 -18.16 56.56 Favored 'General case' 0 C--N 1.33 -0.263 0 C-N-CA 128.508 2.723 . . . . 0.0 115.619 -179.368 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 11' ' ' VAL . . . . . . . . . . . . . 16.0 m -70.73 -6.22 6.79 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.731 0 C-N-CA 127.857 2.463 . . . . 0.0 114.536 -178.906 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 12' ' ' ARG . . . . . . . . . . . . . 57.6 ttt85 -141.09 116.22 9.92 Favored 'General case' 0 C--O 1.236 0.344 0 CA-C-N 119.854 1.206 . . . . 0.0 108.744 179.26 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 13' ' ' GLN . . . . . . . . . . . . . 8.8 pt20 -78.89 96.91 5.81 Favored 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 123.414 0.685 . . . . 0.0 110.395 179.161 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -78.35 -38.31 42.32 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 106.517 -1.66 . . . . 0.0 106.517 177.557 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 1.3 t -73.53 164.94 25.97 Favored 'General case' 0 N--CA 1.444 -0.726 0 CA-C-O 122.032 0.92 . . . . 0.0 108.83 177.669 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 19.4 t -114.39 142.75 25.97 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.573 0 N-CA-C 105.771 -1.937 . . . . 0.0 105.771 179.325 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 12.4 p -135.8 108.93 9.17 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 N-CA-C 106.188 -1.782 . . . . 0.0 106.188 178.675 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 43.4 ttm-85 -134.38 150.04 50.87 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-N 115.855 -0.612 . . . . 0.0 110.1 -179.745 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 22.5 m -88.57 75.45 8.32 Favored 'General case' 0 N--CA 1.45 -0.459 0 C-N-CA 125.264 1.426 . . . . 0.0 108.265 179.801 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 16.6 tp -86.44 136.99 32.9 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 105.947 -1.872 . . . . 0.0 105.947 178.818 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 78.9 mtt180 -132.62 166.75 21.42 Favored 'General case' 0 N--CA 1.451 -0.42 0 C-N-CA 127.182 2.193 . . . . 0.0 110.094 -179.078 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 22' ' ' PHE . . . . . . . . . . . . . 87.6 m-85 -136.76 -178.04 5.01 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 124.611 1.164 . . . . 0.0 110.114 -179.721 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -105.83 173.48 3.2 Favored Pre-proline 0 CA--C 1.542 0.663 0 C-N-CA 124.181 0.992 . . . . 0.0 109.751 179.758 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 24' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -68.32 -37.83 12.99 Favored 'Trans proline' 0 C--N 1.347 0.471 0 C-N-CA 121.55 1.5 . . . . 0.0 114.371 -177.494 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 25' ' ' VAL . . . . . . . . . . . . . 81.6 t -74.97 -41.6 45.93 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.202 0 N-CA-C 108.793 -0.818 . . . . 0.0 108.793 179.489 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -60.39 -51.71 68.32 Favored 'General case' 0 N--CA 1.45 -0.469 0 C-N-CA 126.559 1.944 . . . . 0.0 109.941 -178.776 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 27' ' ' ASP . . . . . . . . . . . . . 16.8 t70 -61.11 -49.85 75.64 Favored 'General case' 0 CA--C 1.512 -0.515 0 C-N-CA 124.732 1.213 . . . . 0.0 110.676 179.601 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 28' ' ' GLU . . . . . . . . . . . . . 31.1 tt0 -58.85 -45.23 90.58 Favored 'General case' 0 N--CA 1.447 -0.601 0 N-CA-C 109.106 -0.701 . . . . 0.0 109.106 -179.757 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 99.1 m -59.97 -55.93 27.93 Favored 'General case' 0 CA--C 1.53 0.199 0 CA-C-N 118.677 0.671 . . . . 0.0 109.288 179.062 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 65.6 mt -55.6 -42.93 71.0 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.215 0 C-N-CA 123.012 0.525 . . . . 0.0 109.912 -179.76 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 77.3 ttt180 -64.41 -44.6 90.73 Favored 'General case' 0 N--CA 1.45 -0.442 0 CA-C-O 118.336 -0.84 . . . . 0.0 111.246 -179.185 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 1.6 mptp? -62.69 -47.19 84.73 Favored 'General case' 0 C--O 1.222 -0.363 0 CA-C-O 118.101 -0.952 . . . . 0.0 109.062 179.579 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 1.5 mptm? -61.83 -47.82 83.37 Favored 'General case' 0 CA--C 1.518 -0.272 0 CA-C-N 119.48 1.036 . . . . 0.0 110.369 -179.736 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 34' ' ' ALA . . . . . . . . . . . . . . . -54.63 -57.86 9.79 Favored 'General case' 0 N--CA 1.448 -0.554 0 C-N-CA 124.94 1.296 . . . . 0.0 109.866 179.456 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 41.3 tt0 -61.81 -41.59 97.95 Favored 'General case' 0 N--CA 1.464 0.273 0 C-N-CA 124.649 1.18 . . . . 0.0 112.271 -178.946 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 36' ' ' ASP . . . . . . . . . . . . . 4.8 t70 -61.02 -42.32 98.24 Favored 'General case' 0 C--N 1.332 -0.184 0 C-N-CA 124.613 1.165 . . . . 0.0 108.393 179.617 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 37' ' ' SER . . . . . . . . . . . . . 29.5 t -77.68 -7.82 57.01 Favored 'General case' 0 N--CA 1.445 -0.684 0 C-N-CA 124.598 1.159 . . . . 0.0 110.839 179.107 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 77.13 15.05 81.97 Favored Glycine 0 CA--C 1.523 0.563 0 CA-C-O 117.061 -1.966 . . . . 0.0 115.998 178.895 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 39' ' ' LEU . . . . . . . . . . . . . 8.3 mt -120.68 143.37 48.76 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-N 120.892 2.346 . . . . 0.0 106.214 179.542 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 40' ' ' THR . . . . . . . . . . . . . 10.1 t -63.85 152.16 40.42 Favored 'General case' 0 C--N 1.321 -0.671 0 O-C-N 120.964 -1.085 . . . . 0.0 108.393 178.939 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 41' ' ' VAL . . . . . . . . . . . . . 52.6 t -48.07 -42.02 10.27 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.254 0 C-N-CA 125.267 1.427 . . . . 0.0 111.452 179.319 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 42' ' ' SER . . . . . . . . . . . . . 70.7 m -57.94 -43.09 86.14 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-N 120.301 1.409 . . . . 0.0 111.716 179.923 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -65.11 -51.04 63.63 Favored 'General case' 0 N--CA 1.452 -0.345 0 N-CA-C 107.529 -1.286 . . . . 0.0 107.529 178.087 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 44' ' ' TYR . . . . . . . . . . . . . 69.5 t80 -53.98 -45.71 71.49 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 123.548 0.739 . . . . 0.0 111.362 -179.647 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 45' ' ' ILE . . . . . . . . . . . . . 16.0 mm -59.47 -68.43 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.34 0.184 0 C-N-CA 125.352 1.461 . . . . 0.0 109.904 179.718 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 46' ' ' ARG . . . . . . . . . . . . . 17.8 ptt85 -51.65 -44.92 63.18 Favored 'General case' 0 C--O 1.219 -0.538 0 CA-C-O 118.971 -0.538 . . . . 0.0 110.537 -178.373 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 47' ' ' ASN . . . . . . . . . . . . . 32.4 t30 -62.43 -47.78 82.56 Favored 'General case' 0 N--CA 1.444 -0.758 0 CA-C-O 117.639 -1.172 . . . . 0.0 112.47 -179.008 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -64.41 -29.14 70.2 Favored 'General case' 0 CA--C 1.531 0.237 0 CA-C-N 119.115 0.87 . . . . 0.0 110.514 179.544 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 49' ' ' ALA . . . . . . . . . . . . . . . -73.75 -21.28 60.25 Favored 'General case' 0 CA--C 1.539 0.522 0 N-CA-C 112.494 0.554 . . . . 0.0 112.494 179.575 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 6.3 mt -101.33 -33.79 9.88 Favored 'General case' 0 N--CA 1.463 0.223 0 C-N-CA 124.532 1.133 . . . . 0.0 109.783 -179.085 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 51' ' ' ASN . . . . . . . . . . . . . 69.4 m-80 . . . . . 0 C--O 1.253 1.263 0 C-N-CA 125.671 1.589 . . . . 0.0 109.11 178.984 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 13.0 m . . . . . 0 N--CA 1.483 1.186 0 CA-C-O 122.873 1.32 . . . . 0.0 108.402 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -80.87 -17.96 48.93 Favored 'General case' 0 C--N 1.321 -0.655 1 C-N-CA 133.501 4.72 . . . . 0.0 111.974 -177.108 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 6.1 t -176.8 172.22 2.1 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 129.74 3.216 . . . . 0.0 105.104 179.378 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -143.13 168.83 18.81 Favored 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 124.657 1.183 . . . . 0.0 108.956 178.656 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 28.8 m -93.72 -178.56 0.44 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.489 0 C-N-CA 124.409 1.084 . . . . 0.0 111.004 -179.4 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -134.8 132.53 38.8 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 124.485 1.114 . . . . 0.0 110.384 -179.21 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 26.5 mtpp -120.55 118.47 30.28 Favored 'General case' 0 C--O 1.233 0.215 0 N-CA-C 106.498 -1.667 . . . . 0.0 106.498 178.824 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 9.4 mtmp? -71.78 159.64 33.99 Favored 'General case' 0 CA--C 1.521 -0.163 0 C-N-CA 123.636 0.774 . . . . 0.0 112.435 -178.684 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 7.4 p -78.42 -27.78 46.64 Favored 'General case' 0 N--CA 1.447 -0.577 0 C-N-CA 125.201 1.4 . . . . 0.0 112.262 179.355 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 28.4 mm-40 -138.43 158.47 44.21 Favored 'General case' 0 C--O 1.239 0.523 0 C-N-CA 125.955 1.702 . . . . 0.0 111.488 -179.094 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 2.2 p -133.58 -42.78 0.53 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.31 0 C-N-CA 126.507 1.923 . . . . 0.0 110.381 179.596 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 50.1 ttt85 -61.54 -56.49 19.44 Favored 'General case' 0 C--O 1.231 0.122 0 C-N-CA 125.134 1.373 . . . . 0.0 111.244 -179.386 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 38.7 mt-30 -124.35 91.71 3.51 Favored 'General case' 0 CA--C 1.52 -0.178 0 N-CA-C 108.464 -0.939 . . . . 0.0 108.464 179.347 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 13.4 ptmm? -68.04 -32.44 72.81 Favored 'General case' 0 C--O 1.223 -0.326 0 N-CA-C 109.841 -0.429 . . . . 0.0 109.841 178.686 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 3.9 t -86.8 161.53 18.3 Favored 'General case' 0 N--CA 1.447 -0.587 0 N-CA-C 108.605 -0.887 . . . . 0.0 108.605 179.245 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 4.1 t -109.0 138.77 34.58 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.635 0 N-CA-C 103.65 -2.722 . . . . 0.0 103.65 178.164 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 11.5 p -140.73 117.26 7.9 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.388 0 N-CA-C 106.639 -1.615 . . . . 0.0 106.639 178.89 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 33.3 ttt180 -150.19 173.31 14.07 Favored 'General case' 0 C--O 1.236 0.375 0 N-CA-C 107.835 -1.172 . . . . 0.0 107.835 -179.782 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 27.1 m -111.46 120.35 41.87 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 104.895 -2.261 . . . . 0.0 104.895 179.078 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -120.62 104.68 10.12 Favored 'General case' 0 N--CA 1.449 -0.511 0 N-CA-C 106.32 -1.733 . . . . 0.0 106.32 179.484 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 26.3 mtm-85 -84.98 157.16 20.86 Favored 'General case' 0 N--CA 1.448 -0.543 0 N-CA-C 109.662 -0.495 . . . . 0.0 109.662 178.874 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 97.5 m-85 -137.66 163.42 31.3 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 108.321 -0.992 . . . . 0.0 108.321 179.936 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 19.3 m -91.98 168.3 13.32 Favored Pre-proline 0 CA--C 1.547 0.834 0 CA-C-O 118.154 -0.927 . . . . 0.0 108.53 179.734 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 45.8 Cg_endo -63.14 -41.97 25.41 Favored 'Trans proline' 0 C--N 1.348 0.529 0 C-N-CA 121.72 1.613 . . . . 0.0 113.03 -177.499 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 65.6 t -68.2 -26.61 34.52 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.363 0 C-N-CA 123.963 0.905 . . . . 0.0 110.561 -179.654 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 4.2 mm-40 -81.65 -38.12 26.42 Favored 'General case' 0 C--N 1.333 -0.124 0 C-N-CA 124.083 0.953 . . . . 0.0 109.572 -179.297 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -69.04 -44.08 73.38 Favored 'General case' 0 C--O 1.221 -0.416 0 C-N-CA 125.429 1.492 . . . . 0.0 108.636 178.626 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 24.6 tt0 -54.22 -52.32 61.64 Favored 'General case' 0 N--CA 1.451 -0.382 0 C-N-CA 126.615 1.966 . . . . 0.0 109.455 179.064 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 72.8 m -65.79 -52.01 54.31 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-O 118.969 -0.538 . . . . 0.0 110.915 -179.4 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 71.1 mt -58.53 -41.75 82.71 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.261 0 CA-C-N 118.191 0.451 . . . . 0.0 110.611 -178.694 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 50.7 ttt85 -64.94 -48.66 73.32 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-O 118.868 -0.586 . . . . 0.0 110.352 -179.516 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 11.7 mptt -63.87 -46.88 82.97 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-O 118.737 -0.649 . . . . 0.0 111.002 -179.243 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.8 -43.38 98.95 Favored 'General case' 0 C--O 1.228 -0.041 0 CA-C-N 118.63 0.65 . . . . 0.0 110.218 -179.508 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -59.16 -52.74 64.42 Favored 'General case' 0 N--CA 1.454 -0.25 0 C-N-CA 123.842 0.857 . . . . 0.0 110.128 179.455 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 18.0 tt0 -59.39 -39.25 82.74 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 123.392 0.677 . . . . 0.0 111.784 -178.896 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -71.3 -40.91 70.56 Favored 'General case' 0 N--CA 1.463 0.196 0 CA-C-N 118.416 0.553 . . . . 0.0 109.913 178.841 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 23.1 t -69.38 -9.04 51.72 Favored 'General case' 0 N--CA 1.448 -0.542 0 C-N-CA 123.606 0.762 . . . . 0.0 110.66 179.788 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 67.42 20.74 71.88 Favored Glycine 0 CA--C 1.527 0.83 0 CA-C-N 119.061 0.846 . . . . 0.0 111.064 -179.203 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 70.6 mt -117.71 116.79 27.74 Favored 'General case' 0 CA--C 1.513 -0.474 0 N-CA-C 104.148 -2.538 . . . . 0.0 104.148 179.791 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 5.2 t -54.24 152.2 6.48 Favored 'General case' 0 CA--C 1.539 0.533 0 N-CA-C 108.551 -0.907 . . . . 0.0 108.551 179.171 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 53.1 t -45.71 -43.25 4.08 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.224 0 C-N-CA 124.02 0.928 . . . . 0.0 111.629 -179.479 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 8.9 p -59.35 -47.03 86.94 Favored 'General case' 0 CA--C 1.536 0.42 0 O-C-N 121.58 -0.7 . . . . 0.0 111.614 -179.954 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -67.01 -43.25 83.36 Favored 'General case' 0 N--CA 1.454 -0.226 0 C-N-CA 124.454 1.102 . . . . 0.0 109.967 178.992 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 36.2 t80 -53.74 -51.38 63.54 Favored 'General case' 0 N--CA 1.453 -0.319 0 C-N-CA 125.265 1.426 . . . . 0.0 109.137 179.684 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 8.3 mm -53.82 -63.21 0.55 Allowed 'Isoleucine or valine' 0 CA--C 1.529 0.14 0 C-N-CA 124.668 1.187 . . . . 0.0 110.093 179.733 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 6.9 ptm180 -56.83 -44.99 82.6 Favored 'General case' 0 C--O 1.224 -0.28 0 CA-C-O 118.296 -0.859 . . . . 0.0 112.718 -178.744 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 25.5 t30 -59.55 -53.07 62.38 Favored 'General case' 0 C--O 1.232 0.143 0 C-N-CA 124.449 1.1 . . . . 0.0 110.468 -179.912 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -62.67 -33.09 74.36 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 123.316 0.646 . . . . 0.0 111.324 179.834 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -75.26 -15.34 60.53 Favored 'General case' 0 CA--C 1.536 0.421 0 N-CA-C 114.128 1.158 . . . . 0.0 114.128 -179.673 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 17.6 mt -107.05 -34.77 7.07 Favored 'General case' 0 CA--C 1.517 -0.297 0 CA-C-N 119.426 1.012 . . . . 0.0 112.418 -179.889 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 56.2 m-80 . . . . . 0 C--O 1.247 0.968 0 C-N-CA 123.654 0.782 . . . . 0.0 111.595 -178.981 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' B' B ' 1' ' ' SER . . . . . . . . . . . . . 12.3 m . . . . . 0 N--CA 1.483 1.211 0 CA-C-O 122.85 1.309 . . . . 0.0 108.494 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' B' B ' 2' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -77.15 -32.21 56.15 Favored 'General case' 0 C--N 1.319 -0.747 1 C-N-CA 133.344 4.657 . . . . 0.0 111.383 -177.247 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 3' ' ' SER . . . . . . . . . . . . . 5.1 t -159.53 179.26 9.07 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 126.93 2.092 . . . . 0.0 106.463 179.134 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 4' ' ' ALA . . . . . . . . . . . . . . . -140.36 -176.78 4.75 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 124.931 1.292 . . . . 0.0 110.853 -179.535 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 16.7 m -129.08 158.16 41.79 Favored 'Isoleucine or valine' 0 C--O 1.239 0.537 0 C-N-CA 126.053 1.741 . . . . 0.0 108.449 179.435 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 6' ' ' ARG . . . . . . . . . . . . . 25.4 mmt180 -120.36 163.0 18.52 Favored 'General case' 0 N--CA 1.464 0.274 0 C-N-CA 123.578 0.751 . . . . 0.0 110.118 -179.576 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 20.8 mttp -142.4 132.44 24.51 Favored 'General case' 0 C--N 1.331 -0.199 0 C-N-CA 126.205 1.802 . . . . 0.0 106.268 179.496 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 7.1 mtmp? -71.51 163.06 28.44 Favored 'General case' 0 C--O 1.236 0.38 0 CA-C-N 118.292 0.496 . . . . 0.0 110.408 -179.729 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 5.3 p -71.25 -76.94 0.1 Allowed 'General case' 0 N--CA 1.45 -0.459 0 C-N-CA 124.881 1.273 . . . . 0.0 109.111 179.332 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 10' ' ' GLU . . . . . . . . . . . . . 51.4 mm-40 -76.24 168.66 19.65 Favored 'General case' 0 C--O 1.236 0.374 0 C-N-CA 124.579 1.152 . . . . 0.0 112.141 -179.391 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 11' ' ' VAL . . . . . . . . . . . . . 33.9 m -132.24 -50.88 0.76 Allowed 'Isoleucine or valine' 0 C--O 1.236 0.392 0 C-N-CA 125.629 1.571 . . . . 0.0 110.396 179.245 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 12' ' ' ARG . . . . . . . . . . . . . 28.8 ttt85 -65.63 -52.65 50.3 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-N 119.132 0.878 . . . . 0.0 111.474 -178.269 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 13' ' ' GLN . . . . . . . . . . . . . 47.4 mt-30 -135.17 99.65 4.32 Favored 'General case' 0 CA--C 1.517 -0.294 0 C-N-CA 123.941 0.896 . . . . 0.0 108.677 178.91 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 10.4 ptmm? -62.31 -33.74 75.26 Favored 'General case' 0 C--O 1.225 -0.226 0 CA-C-N 115.638 -0.71 . . . . 0.0 109.881 178.356 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 4.1 t -89.21 157.24 18.32 Favored 'General case' 0 N--CA 1.439 -0.985 0 C-N-CA 124.327 1.051 . . . . 0.0 110.548 -179.618 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 36.0 t -101.51 152.42 5.27 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 N-CA-C 105.409 -2.071 . . . . 0.0 105.409 178.422 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 11.1 p -147.66 110.82 0.72 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 N-CA-C 103.501 -2.777 . . . . 0.0 103.501 178.121 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 32.2 ttt180 -145.0 158.71 43.73 Favored 'General case' 0 C--O 1.233 0.197 0 O-C-N 121.274 -0.891 . . . . 0.0 113.299 -178.425 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 3.9 m -92.23 80.18 5.03 Favored 'General case' 0 N--CA 1.451 -0.377 0 C-N-CA 125.998 1.719 . . . . 0.0 107.812 -179.361 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -85.62 93.02 8.72 Favored 'General case' 0 C--N 1.326 -0.439 0 O-C-N 121.32 -0.863 . . . . 0.0 109.102 -179.453 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 14.5 mmm-85 -78.44 154.2 30.82 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 122.987 0.515 . . . . 0.0 110.179 179.101 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 22' ' ' PHE . . . . . . . . . . . . . 92.0 m-85 -141.35 174.18 10.78 Favored 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 125.506 1.522 . . . . 0.0 108.269 179.139 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 3.2 m -104.25 176.66 1.67 Allowed Pre-proline 0 CA--C 1.544 0.716 0 CA-C-O 117.809 -1.091 . . . . 0.0 110.124 179.562 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 24' ' ' PRO . . . . . . . . . . . . . 85.7 Cg_endo -77.17 -29.0 5.35 Favored 'Trans proline' 0 C--N 1.35 0.62 0 CA-C-N 121.519 1.578 . . . . 0.0 112.634 -178.107 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 25' ' ' VAL . . . . . . . . . . . . . 11.4 t -75.66 -34.66 29.34 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.177 0 N-CA-C 107.295 -1.372 . . . . 0.0 107.295 179.237 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -69.08 -45.63 69.8 Favored 'General case' 0 N--CA 1.447 -0.595 0 N-CA-C 107.48 -1.304 . . . . 0.0 107.48 178.41 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 27' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -60.7 -49.3 78.05 Favored 'General case' 0 C--O 1.218 -0.601 0 N-CA-C 109.194 -0.669 . . . . 0.0 109.194 179.097 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 28' ' ' GLU . . . . . . . . . . . . . 36.4 tt0 -61.32 -23.03 65.43 Favored 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 123.965 0.906 . . . . 0.0 111.48 -179.806 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 88.6 m -85.21 -53.92 4.94 Favored 'General case' 0 N--CA 1.452 -0.35 0 N-CA-C 108.035 -1.098 . . . . 0.0 108.035 178.616 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 58.8 mt -58.43 -46.16 89.57 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.507 0 C-N-CA 124.591 1.156 . . . . 0.0 110.18 -179.278 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 54.0 ttt85 -59.98 -52.33 65.87 Favored 'General case' 0 N--CA 1.451 -0.387 0 C-N-CA 124.299 1.04 . . . . 0.0 110.142 -179.456 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 5.9 mptt -59.42 -48.44 81.65 Favored 'General case' 0 N--CA 1.456 -0.164 0 O-C-N 123.711 0.632 . . . . 0.0 110.499 -179.073 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -67.02 -38.46 86.0 Favored 'General case' 0 C--O 1.226 -0.158 0 CA-C-N 118.123 0.42 . . . . 0.0 112.085 -178.586 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 34' ' ' ALA . . . . . . . . . . . . . . . -59.94 -52.81 63.82 Favored 'General case' 0 N--CA 1.452 -0.371 0 C-N-CA 124.015 0.926 . . . . 0.0 108.79 179.034 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 5.9 tt0 -65.73 -30.84 71.57 Favored 'General case' 0 CA--C 1.534 0.348 0 O-C-N 122.217 -0.302 . . . . 0.0 110.755 -178.962 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 36' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -67.32 -42.29 83.86 Favored 'General case' 0 N--CA 1.462 0.147 0 C-N-CA 124.264 1.026 . . . . 0.0 108.242 178.697 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 37' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -74.51 -21.57 59.48 Favored 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 124.356 1.063 . . . . 0.0 110.675 178.781 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 85.56 -5.93 81.91 Favored Glycine 0 CA--C 1.537 1.428 0 N-CA-C 109.71 -1.356 . . . . 0.0 109.71 -177.688 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 39' ' ' LEU . . . . . . . . . . . . . 84.4 mt -89.01 110.27 20.99 Favored 'General case' 0 N--CA 1.445 -0.687 0 C-N-CA 128.144 2.578 . . . . 0.0 105.68 179.312 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 40' ' ' THR . . . . . . . . . . . . . 5.0 t -48.04 155.2 0.47 Allowed 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 123.777 0.831 . . . . 0.0 109.589 178.184 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 41' ' ' VAL . . . . . . . . . . . . . 52.9 t -45.65 -43.2 3.95 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.505 0 C-N-CA 124.479 1.112 . . . . 0.0 111.441 -179.392 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 42' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -64.26 -35.64 81.49 Favored 'General case' 0 CA--C 1.542 0.638 0 O-C-N 121.487 -0.758 . . . . 0.0 112.93 179.823 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -76.25 -44.51 37.09 Favored 'General case' 0 C--O 1.226 -0.162 0 C-N-CA 126.277 1.831 . . . . 0.0 108.957 178.579 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 44' ' ' TYR . . . . . . . . . . . . . 64.0 t80 -55.69 -51.93 65.59 Favored 'General case' 0 N--CA 1.446 -0.659 0 C-N-CA 124.812 1.245 . . . . 0.0 109.256 179.5 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 45' ' ' ILE . . . . . . . . . . . . . 21.6 mm -54.96 -60.43 1.6 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.395 0 C-N-CA 123.86 0.864 . . . . 0.0 111.739 179.653 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 46' ' ' ARG . . . . . . . . . . . . . 3.3 ptm180 -53.91 -45.58 71.21 Favored 'General case' 0 C--O 1.224 -0.246 0 CA-C-O 118.429 -0.796 . . . . 0.0 111.368 -179.508 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 47' ' ' ASN . . . . . . . . . . . . . 27.4 t30 -62.24 -57.02 12.96 Favored 'General case' 0 N--CA 1.452 -0.343 0 C-N-CA 124.939 1.296 . . . . 0.0 110.878 -179.473 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -58.13 -30.58 66.44 Favored 'General case' 0 C--N 1.334 -0.093 0 C-N-CA 123.891 0.876 . . . . 0.0 113.264 -178.725 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 49' ' ' ALA . . . . . . . . . . . . . . . -82.58 -29.35 30.31 Favored 'General case' 0 N--CA 1.451 -0.41 0 N-CA-C 114.274 1.213 . . . . 0.0 114.274 -179.208 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 43.7 mt -84.88 -37.6 20.43 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-N 119.084 0.856 . . . . 0.0 111.171 -179.234 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 51' ' ' ASN . . . . . . . . . . . . . 63.5 m-20 . . . . . 0 C--O 1.251 1.149 0 CA-C-O 116.576 -1.678 . . . . 0.0 110.324 179.33 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 10.8 m . . . . . 0 CA--C 1.512 -0.506 0 N-CA-C 107.163 -1.421 . . . . 0.0 107.163 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -58.61 -50.82 72.41 Favored 'General case' 0 C--N 1.323 -0.559 0 C-N-CA 128.21 2.604 . . . . 0.0 109.924 -178.988 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 9.8 p -163.21 -84.05 0.03 OUTLIER 'General case' 0 N--CA 1.454 -0.265 0 N-CA-C 107.936 -1.135 . . . . 0.0 107.936 178.904 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -143.09 177.07 8.63 Favored 'General case' 0 CA--C 1.53 0.189 0 C-N-CA 125.776 1.63 . . . . 0.0 109.11 179.744 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 8.6 p -143.68 170.34 9.61 Favored 'Isoleucine or valine' 0 C--O 1.238 0.495 0 N-CA-C 108.242 -1.022 . . . . 0.0 108.242 179.814 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 4.3 ptp180 -141.35 162.26 35.9 Favored 'General case' 0 C--N 1.333 -0.145 0 C-N-CA 125.399 1.48 . . . . 0.0 108.564 179.347 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 12.2 pttp -167.89 174.47 7.45 Favored 'General case' 0 C--N 1.328 -0.329 0 C-N-CA 126.086 1.754 . . . . 0.0 107.098 179.485 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 35.4 mtpt -62.33 131.3 48.87 Favored 'General case' 0 CA--C 1.535 0.373 0 N-CA-C 103.511 -2.774 . . . . 0.0 103.511 175.905 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -119.17 -67.94 0.95 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 119.845 1.202 . . . . 0.0 107.921 179.684 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 21.1 mt-10 -143.31 172.11 13.21 Favored 'General case' 0 C--O 1.239 0.53 0 C-N-CA 125.802 1.641 . . . . 0.0 108.286 179.605 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -162.64 134.38 0.96 Allowed 'Isoleucine or valine' 0 C--O 1.239 0.533 0 C-N-CA 125.22 1.408 . . . . 0.0 107.23 178.338 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 6.7 ttm180 -166.44 -172.89 2.33 Favored 'General case' 0 C--O 1.241 0.658 0 N-CA-C 105.805 -1.924 . . . . 0.0 105.805 178.932 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 8.8 mp0 -82.0 76.04 8.91 Favored 'General case' 0 N--CA 1.453 -0.294 0 N-CA-C 108.44 -0.948 . . . . 0.0 108.44 179.752 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 44.6 pttt -64.18 -33.46 75.84 Favored 'General case' 0 C--O 1.221 -0.414 0 C-N-CA 123.833 0.853 . . . . 0.0 109.906 178.476 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 4.1 t -81.06 165.09 21.97 Favored 'General case' 0 N--CA 1.437 -1.097 0 CA-C-O 122.161 0.981 . . . . 0.0 108.355 178.902 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 24.7 t -109.71 147.03 14.39 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.763 0 N-CA-C 104.437 -2.431 . . . . 0.0 104.437 176.665 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 11.3 p -143.44 105.45 1.01 Allowed 'Isoleucine or valine' 0 N--CA 1.445 -0.709 0 N-CA-C 104.431 -2.433 . . . . 0.0 104.431 178.198 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 49.5 ttm-85 -148.34 156.02 42.0 Favored 'General case' 0 C--N 1.325 -0.462 0 C-N-CA 123.245 0.618 . . . . 0.0 109.743 -179.344 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 23.4 m -103.62 129.7 50.94 Favored 'General case' 0 N--CA 1.451 -0.402 0 N-CA-C 104.07 -2.567 . . . . 0.0 104.07 178.445 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -135.98 111.66 9.36 Favored 'General case' 0 N--CA 1.453 -0.322 0 N-CA-C 108.163 -1.051 . . . . 0.0 108.163 -178.413 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 89.4 mtm-85 -86.06 138.93 31.58 Favored 'General case' 0 N--CA 1.462 0.168 0 CA-C-O 117.369 -1.3 . . . . 0.0 112.345 -178.805 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 32.2 m-85 -123.0 159.39 28.47 Favored 'General case' 0 N--CA 1.481 1.112 0 C-N-CA 127.12 2.168 . . . . 0.0 110.195 -178.62 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 1.9 m -80.75 167.72 30.48 Favored Pre-proline 0 CA--C 1.541 0.614 0 CA-C-N 119.097 0.862 . . . . 0.0 109.691 179.7 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 41.8 Cg_endo -65.25 -42.17 14.19 Favored 'Trans proline' 0 N--CA 1.459 -0.535 0 C-N-CA 121.929 1.752 . . . . 0.0 112.373 -179.653 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 77.1 t -58.39 -53.07 51.47 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.315 0 N-CA-C 108.075 -1.083 . . . . 0.0 108.075 179.757 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 -56.84 -46.03 81.98 Favored 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 124.451 1.1 . . . . 0.0 110.863 179.453 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 19.3 t70 -60.24 -50.1 75.01 Favored 'General case' 0 CA--C 1.512 -0.511 0 C-N-CA 124.072 0.949 . . . . 0.0 112.549 -179.618 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -60.24 -43.61 95.93 Favored 'General case' 0 N--CA 1.452 -0.338 0 N-CA-C 109.645 -0.502 . . . . 0.0 109.645 -179.783 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 63.1 m -58.71 -54.42 47.29 Favored 'General case' 0 N--CA 1.451 -0.385 0 N-CA-C 109.293 -0.632 . . . . 0.0 109.293 179.448 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 78.3 mt -58.14 -45.58 88.56 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.362 0 C-N-CA 123.008 0.523 . . . . 0.0 109.727 -179.673 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 29.1 ttt180 -61.65 -43.61 98.53 Favored 'General case' 0 C--N 1.334 -0.076 0 O-C-N 121.358 -0.839 . . . . 0.0 112.225 -178.941 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -68.81 -47.69 65.46 Favored 'General case' 0 CA--C 1.528 0.127 0 CA-C-N 118.915 0.78 . . . . 0.0 109.922 -179.7 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 71.8 mmtt -63.93 -46.42 84.82 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-N 118.819 0.736 . . . . 0.0 112.098 -178.885 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -60.01 -52.48 65.19 Favored 'General case' 0 N--CA 1.448 -0.549 0 C-N-CA 122.53 0.332 . . . . 0.0 110.614 -179.482 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 26.9 tp10 -62.8 -37.35 86.37 Favored 'General case' 0 N--CA 1.454 -0.263 0 CA-C-N 116.594 -0.276 . . . . 0.0 111.4 -178.646 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -63.79 -38.89 92.79 Favored 'General case' 0 CA--C 1.527 0.059 0 N-CA-C 108.685 -0.857 . . . . 0.0 108.685 179.282 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 33.1 t -75.19 -10.45 59.48 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 123.76 0.824 . . . . 0.0 110.725 178.69 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 77.77 4.02 84.7 Favored Glycine 0 CA--C 1.528 0.861 0 O-C-N 120.791 -1.193 . . . . 0.0 113.246 179.365 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 1.8 mt -118.66 115.86 25.39 Favored 'General case' 0 CA--C 1.508 -0.656 0 N-CA-C 102.685 -3.08 . . . . 0.0 102.685 179.448 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 3.1 t -46.72 160.54 0.08 Allowed 'General case' 0 C--N 1.323 -0.552 0 C-N-CA 125.615 1.566 . . . . 0.0 112.499 -179.031 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 9.2 m -47.06 -38.39 4.36 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.591 0 N-CA-C 114.13 1.159 . . . . 0.0 114.13 -177.72 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 6.9 p -66.05 -52.2 51.24 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-N 119.485 1.039 . . . . 0.0 109.898 179.153 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -56.88 -43.44 81.27 Favored 'General case' 0 CA--C 1.531 0.223 0 C-N-CA 124.185 0.994 . . . . 0.0 109.356 178.185 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 83.3 t80 -58.51 -52.28 66.32 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 124.04 0.936 . . . . 0.0 108.952 178.794 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 2.4 mm -53.39 -63.8 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.343 0.308 0 C-N-CA 126.176 1.79 . . . . 0.0 110.011 179.76 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 2.4 ptm180 -56.13 -43.02 77.8 Favored 'General case' 0 CA--C 1.516 -0.347 0 CA-C-O 117.675 -1.155 . . . . 0.0 111.637 -178.693 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 9.3 t30 -61.3 -54.71 40.51 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 119.459 1.027 . . . . 0.0 110.49 179.368 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -60.16 -32.92 71.5 Favored 'General case' 0 C--O 1.224 -0.282 0 C-N-CA 123.479 0.712 . . . . 0.0 112.157 -179.17 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -71.39 -27.04 63.04 Favored 'General case' 0 CA--C 1.535 0.382 0 N-CA-C 112.975 0.732 . . . . 0.0 112.975 -179.663 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 19.4 mt -92.48 -35.66 13.51 Favored 'General case' 0 CA--C 1.518 -0.267 0 C-N-CA 123.413 0.685 . . . . 0.0 109.81 -179.758 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 78.4 m-20 . . . . . 0 C--O 1.251 1.133 0 C-N-CA 125.334 1.454 . . . . 0.0 109.669 -180.0 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B ' 1' ' ' SER . . . . . . . . . . . . . 6.2 p . . . . . 0 N--CA 1.466 0.368 0 N-CA-C 108.149 -1.056 . . . . 0.0 108.149 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B ' 2' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -63.4 -22.0 66.62 Favored 'General case' 0 C--N 1.324 -0.534 0 C-N-CA 128.496 2.719 . . . . 0.0 111.508 -179.496 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 3' ' ' SER . . . . . . . . . . . . . 18.4 p -153.33 -177.54 6.4 Favored 'General case' 0 C--O 1.24 0.553 0 C-N-CA 125.701 1.6 . . . . 0.0 108.988 179.699 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 4' ' ' ALA . . . . . . . . . . . . . . . -128.19 161.4 29.39 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 126.443 1.897 . . . . 0.0 107.668 179.285 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 7.2 p -126.99 104.31 12.39 Favored 'Isoleucine or valine' 0 C--O 1.238 0.456 0 CA-C-O 122.043 0.925 . . . . 0.0 111.08 -178.797 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 6' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -92.66 143.5 26.25 Favored 'General case' 0 N--CA 1.463 0.219 0 C-N-CA 124.142 0.977 . . . . 0.0 108.392 179.056 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -160.62 160.38 31.61 Favored 'General case' 0 N--CA 1.467 0.393 0 C-N-CA 124.131 0.973 . . . . 0.0 110.702 179.676 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 24.4 mtpt 30.54 50.57 0.09 Allowed 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 129.566 3.146 . . . . 0.0 113.525 179.197 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 8.3 t -60.66 -70.67 0.16 Allowed 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 123.956 0.902 . . . . 0.0 111.851 -178.794 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 10' ' ' GLU . . . . . . . . . . . . . 5.1 tp10 -149.49 163.02 38.96 Favored 'General case' 0 C--O 1.235 0.3 0 O-C-N 121.093 -1.005 . . . . 0.0 109.177 -179.423 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 11' ' ' VAL . . . . . . . . . . . . . 13.7 t -139.83 94.37 0.77 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.27 0 N-CA-C 104.324 -2.473 . . . . 0.0 104.324 178.451 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 12' ' ' ARG . . . . . . . . . . . . . 37.4 ttm180 -141.68 166.0 25.95 Favored 'General case' 0 C--O 1.236 0.393 0 N-CA-C 108.068 -1.086 . . . . 0.0 108.068 -179.343 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 13' ' ' GLN . . . . . . . . . . . . . 16.2 mp0 -78.61 65.78 3.96 Favored 'General case' 0 C--O 1.234 0.27 0 N-CA-C 107.551 -1.277 . . . . 0.0 107.551 179.303 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 37.2 pttt -60.32 -38.79 84.83 Favored 'General case' 0 N--CA 1.452 -0.364 0 C-N-CA 124.767 1.227 . . . . 0.0 109.035 179.872 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 6.4 t -68.88 164.71 21.45 Favored 'General case' 0 N--CA 1.44 -0.967 0 CA-C-O 123.237 1.494 . . . . 0.0 109.885 178.363 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 36.4 t -102.42 146.53 10.31 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.873 0 N-CA-C 101.964 -3.347 . . . . 0.0 101.964 175.004 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 9.5 p -148.14 100.0 0.37 Allowed 'Isoleucine or valine' 0 N--CA 1.442 -0.861 0 N-CA-C 102.51 -3.144 . . . . 0.0 102.51 177.254 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 46.3 ttm-85 -142.34 160.51 40.11 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.057 -0.974 . . . . 0.0 109.282 -178.77 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -108.85 122.64 47.62 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 101.278 -3.601 . . . . 0.0 101.278 178.396 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 7.5 tt -134.44 112.62 11.08 Favored 'General case' 0 N--CA 1.463 0.208 0 C-N-CA 124.609 1.163 . . . . 0.0 109.199 -177.02 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 75.1 mtm-85 -78.98 162.45 25.95 Favored 'General case' 0 N--CA 1.47 0.562 0 N-CA-C 113.52 0.933 . . . . 0.0 113.52 -178.763 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 22' ' ' PHE . . . . . . . . . . . . . 45.4 m-85 -143.05 160.75 39.78 Favored 'General case' 0 N--CA 1.47 0.549 0 C-N-CA 127.117 2.167 . . . . 0.0 107.388 179.361 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 3.1 m -88.97 173.91 5.57 Favored Pre-proline 0 CA--C 1.545 0.756 0 C-N-CA 124.692 1.197 . . . . 0.0 109.899 179.823 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 24' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -68.1 -47.47 1.72 Allowed 'Trans proline' 0 C--N 1.352 0.757 0 C-N-CA 121.687 1.591 . . . . 0.0 112.17 -178.543 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 25' ' ' VAL . . . . . . . . . . . . . 33.8 t -67.51 -31.23 51.76 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.388 0 C-N-CA 123.913 0.885 . . . . 0.0 110.296 -179.583 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 58.1 mt-10 -70.08 -48.7 56.66 Favored 'General case' 0 CA--C 1.529 0.137 0 N-CA-C 108.012 -1.107 . . . . 0.0 108.012 179.409 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 27' ' ' ASP . . . . . . . . . . . . . 23.8 t70 -60.38 -43.67 96.37 Favored 'General case' 0 C--O 1.219 -0.545 0 C-N-CA 124.968 1.307 . . . . 0.0 110.717 179.37 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 28' ' ' GLU . . . . . . . . . . . . . 12.9 tt0 -56.43 -52.2 65.54 Favored 'General case' 0 N--CA 1.454 -0.254 0 C-N-CA 124.768 1.227 . . . . 0.0 110.146 -179.696 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 4.1 m -56.71 -55.48 33.62 Favored 'General case' 0 CA--C 1.53 0.199 0 N-CA-C 109.118 -0.697 . . . . 0.0 109.118 178.96 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 73.2 mt -54.12 -50.92 51.58 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.202 0 C-N-CA 123.279 0.631 . . . . 0.0 110.845 -178.986 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 58.9 ttt180 -56.89 -48.31 78.47 Favored 'General case' 0 N--CA 1.449 -0.507 0 C-N-CA 124.587 1.155 . . . . 0.0 111.331 -178.952 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 1.9 mptm? -65.65 -45.98 80.93 Favored 'General case' 0 CA--C 1.515 -0.398 0 O-C-N 123.909 0.756 . . . . 0.0 110.379 -179.519 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 34.9 mmtt -62.47 -44.6 96.0 Favored 'General case' 0 C--N 1.333 -0.117 0 CA-C-N 119.455 1.025 . . . . 0.0 110.239 -179.02 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 34' ' ' ALA . . . . . . . . . . . . . . . -58.2 -54.61 45.05 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 124.866 1.267 . . . . 0.0 110.024 179.192 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 7.4 tp10 -66.57 -16.78 64.41 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 124.635 1.174 . . . . 0.0 112.775 -179.055 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 36' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -102.05 4.61 39.95 Favored 'General case' 0 C--N 1.327 -0.409 0 C-N-CA 126.015 1.726 . . . . 0.0 111.466 -179.899 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 37' ' ' SER . . . . . . . . . . . . . 9.1 t -127.59 -1.27 6.15 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 124.424 1.09 . . . . 0.0 112.094 179.825 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 67.79 28.72 73.45 Favored Glycine 0 CA--C 1.529 0.936 0 CA-C-N 119.876 1.216 . . . . 0.0 110.64 -178.892 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 39' ' ' LEU . . . . . . . . . . . . . 90.0 mt -120.1 125.24 47.79 Favored 'General case' 0 N--CA 1.444 -0.725 0 C-N-CA 126.041 1.736 . . . . 0.0 106.94 -179.061 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 40' ' ' THR . . . . . 0.465 HG22 ' H ' ' B' ' 43' ' ' ALA . 1.8 t -63.8 153.83 35.33 Favored 'General case' 0 CA--C 1.538 0.502 0 N-CA-C 104.703 -2.332 . . . . 0.0 104.703 176.8 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 41' ' ' VAL . . . . . . . . . . . . . 55.1 t -48.64 -38.75 10.01 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.498 0 O-C-N 121.392 -0.818 . . . . 0.0 110.261 179.071 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 42' ' ' SER . . . . . . . . . . . . . 14.4 m -62.39 -46.55 88.09 Favored 'General case' 0 CA--C 1.533 0.324 0 O-C-N 121.057 -1.027 . . . . 0.0 111.368 179.085 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 43' ' ' ALA . . . . . 0.465 ' H ' HG22 ' B' ' 40' ' ' THR . . . -64.9 -40.91 95.83 Favored 'General case' 0 C--N 1.34 0.164 0 C-N-CA 123.913 0.885 . . . . 0.0 109.23 178.803 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 44' ' ' TYR . . . . . . . . . . . . . 57.3 t80 -58.45 -50.92 71.99 Favored 'General case' 0 CA--C 1.539 0.54 0 N-CA-C 108.276 -1.009 . . . . 0.0 108.276 179.106 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 45' ' ' ILE . . . . . . . . . . . . . 12.9 mm -56.74 -61.32 1.26 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.301 0 C-N-CA 125.122 1.369 . . . . 0.0 108.609 178.807 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 46' ' ' ARG . . . . . . . . . . . . . 40.2 mtp180 -43.9 -66.01 0.43 Allowed 'General case' 0 C--O 1.219 -0.51 0 C-N-CA 126.044 1.738 . . . . 0.0 110.588 179.781 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 47' ' ' ASN . . . . . . . . . . . . . 20.5 t30 -53.25 -49.54 66.67 Favored 'General case' 0 N--CA 1.441 -0.88 0 C-N-CA 124.719 1.208 . . . . 0.0 113.601 -178.04 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -63.18 -31.62 72.81 Favored 'General case' 0 CA--C 1.535 0.399 0 CA-C-N 118.99 0.814 . . . . 0.0 111.264 179.514 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 49' ' ' ALA . . . . . . . . . . . . . . . -78.68 -16.09 57.7 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 124.067 0.947 . . . . 0.0 113.512 -179.712 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 13.9 mt -100.32 -38.02 8.63 Favored 'General case' 0 C--O 1.234 0.283 0 O-C-N 121.451 -0.781 . . . . 0.0 109.981 179.886 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 51' ' ' ASN . . . . . . . . . . . . . 43.2 m-80 . . . . . 0 C--O 1.246 0.907 0 C-N-CA 124.502 1.121 . . . . 0.0 110.136 179.155 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 5.2 t . . . . . 0 N--CA 1.471 0.589 0 N-CA-C 105.85 -1.907 . . . . 0.0 105.85 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -141.89 139.24 32.53 Favored 'General case' 0 C--O 1.236 0.37 0 CA-C-N 118.826 0.739 . . . . 0.0 109.721 -177.808 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 20.1 m -73.73 162.73 28.84 Favored 'General case' 0 CA--C 1.535 0.397 0 N-CA-C 108.736 -0.838 . . . . 0.0 108.736 178.978 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -126.58 -18.51 4.79 Favored 'General case' 0 C--O 1.235 0.339 0 N-CA-C 113.212 0.819 . . . . 0.0 113.212 -179.896 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 9.6 m -157.26 170.75 0.55 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.417 0 C-N-CA 128.231 2.613 . . . . 0.0 106.819 178.959 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 91.1 mtt180 -140.02 -75.84 0.34 Allowed 'General case' 0 N--CA 1.464 0.26 0 C-N-CA 123.321 0.649 . . . . 0.0 109.411 178.499 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 36.5 mtmt -121.53 155.84 34.12 Favored 'General case' 0 C--O 1.235 0.335 0 C-N-CA 124.324 1.05 . . . . 0.0 109.136 -179.595 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 95.4 mttt -132.79 167.83 19.45 Favored 'General case' 0 C--O 1.236 0.376 0 C-N-CA 124.957 1.303 . . . . 0.0 109.758 -179.566 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 31.7 p -152.07 173.01 15.42 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 108.893 -0.78 . . . . 0.0 108.893 178.999 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 22.8 tt0 -120.08 6.2 10.81 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 125.056 1.343 . . . . 0.0 110.49 179.64 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 9.8 p -113.9 5.34 7.82 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.66 0 C-N-CA 126.64 1.976 . . . . 0.0 110.643 179.793 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 13.6 tpt180 -128.27 105.9 8.66 Favored 'General case' 0 CA--C 1.515 -0.4 0 N-CA-C 107.105 -1.443 . . . . 0.0 107.105 179.81 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 6.6 pt20 -71.69 105.74 3.82 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 105.318 -2.104 . . . . 0.0 105.318 178.147 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.19 -27.67 65.92 Favored 'General case' 0 N--CA 1.465 0.311 0 C-N-CA 122.819 0.448 . . . . 0.0 111.285 179.618 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 12.2 t -76.51 -176.86 3.89 Favored 'General case' 0 N--CA 1.436 -1.159 0 CA-C-O 124.107 1.908 . . . . 0.0 110.89 178.966 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 16.1 t -122.92 144.19 33.26 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.961 1 N-CA-C 100.072 -4.047 . . . . 0.0 100.072 176.51 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 13.1 p -136.9 102.08 2.57 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.021 0 N-CA-C 104.244 -2.502 . . . . 0.0 104.244 179.234 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 6.0 mtt-85 -128.25 158.96 36.7 Favored 'General case' 0 CA--C 1.509 -0.603 0 CA-C-O 123.103 1.43 . . . . 0.0 109.792 -179.969 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 3.7 m -94.2 83.21 4.21 Favored 'General case' 0 N--CA 1.439 -1.003 0 N-CA-C 104.049 -2.574 . . . . 0.0 104.049 -179.234 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -84.17 92.67 7.98 Favored 'General case' 0 C--N 1.325 -0.458 0 C-N-CA 124.294 1.037 . . . . 0.0 111.058 -177.771 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -74.2 146.48 43.34 Favored 'General case' 0 N--CA 1.447 -0.596 0 C-N-CA 123.961 0.904 . . . . 0.0 112.666 179.204 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 90.5 m-85 -137.11 152.29 49.83 Favored 'General case' 0 C--O 1.238 0.458 0 C-N-CA 126.624 1.97 . . . . 0.0 106.088 177.274 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 1.2 m -86.52 167.68 21.82 Favored Pre-proline 0 CA--C 1.543 0.692 0 N-CA-C 106.59 -1.633 . . . . 0.0 106.59 179.438 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -66.76 -30.84 40.73 Favored 'Trans proline' 0 CA--C 1.531 0.368 0 CA-C-N 121.201 1.465 . . . . 0.0 111.428 -179.355 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 44.8 t -69.32 -45.29 79.35 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.322 0 N-CA-C 108.456 -0.942 . . . . 0.0 108.456 179.308 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -64.37 -46.24 84.26 Favored 'General case' 0 C--O 1.224 -0.276 0 N-CA-C 109.52 -0.548 . . . . 0.0 109.52 -179.789 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -58.35 -44.21 88.66 Favored 'General case' 0 CA--C 1.513 -0.458 0 C-N-CA 123.874 0.87 . . . . 0.0 111.233 -179.772 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 15.3 tm-20 -62.24 -51.39 67.95 Favored 'General case' 0 N--CA 1.448 -0.565 0 N-CA-C 109.166 -0.679 . . . . 0.0 109.166 179.856 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 88.9 m -59.38 -53.41 58.56 Favored 'General case' 0 CA--C 1.534 0.34 0 CA-C-N 118.353 0.524 . . . . 0.0 110.009 179.482 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 83.9 mt -57.97 -43.53 85.0 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.293 0 C-N-CA 124.193 0.997 . . . . 0.0 109.861 -179.283 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 40.8 ttt180 -62.94 -42.23 99.74 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-N 119.296 0.953 . . . . 0.0 110.16 -179.63 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 4.7 mptp? -68.98 -47.71 64.91 Favored 'General case' 0 CA--C 1.515 -0.38 0 CA-C-O 118.843 -0.598 . . . . 0.0 109.864 -179.554 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 21.3 tptt -63.01 -41.1 99.48 Favored 'General case' 0 C--O 1.224 -0.27 0 CA-C-O 119.005 -0.521 . . . . 0.0 110.536 -179.488 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -61.08 -53.45 57.0 Favored 'General case' 0 N--CA 1.453 -0.294 0 C-N-CA 124.841 1.257 . . . . 0.0 109.236 179.071 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 30.5 tt0 -57.84 -44.23 86.38 Favored 'General case' 0 N--CA 1.453 -0.303 0 C-N-CA 122.966 0.507 . . . . 0.0 111.17 -179.299 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 27.0 t0 -67.33 -39.61 85.86 Favored 'General case' 0 C--N 1.332 -0.156 0 C-N-CA 123.378 0.671 . . . . 0.0 109.9 -179.85 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 22.9 t -72.3 -9.17 58.14 Favored 'General case' 0 N--CA 1.451 -0.403 0 C-N-CA 124.53 1.132 . . . . 0.0 111.007 179.66 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 65.49 29.76 75.95 Favored Glycine 0 CA--C 1.53 1.012 0 CA-C-N 119.391 0.996 . . . . 0.0 111.683 -179.682 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 71.6 mt -133.42 115.65 15.09 Favored 'General case' 0 N--CA 1.451 -0.42 0 N-CA-C 103.797 -2.668 . . . . 0.0 103.797 179.703 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 14.8 t -57.13 161.65 3.01 Favored 'General case' 0 CA--C 1.535 0.391 0 CA-C-N 119.276 0.944 . . . . 0.0 110.19 -179.843 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 97.7 t -44.19 -45.77 2.24 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.213 0 C-N-CA 126.118 1.767 . . . . 0.0 111.555 -178.812 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 2.5 p -64.19 -47.49 79.58 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-N 120.304 1.411 . . . . 0.0 112.076 -179.806 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -62.1 -44.28 97.0 Favored 'General case' 0 C--O 1.222 -0.353 0 C-N-CA 124.412 1.085 . . . . 0.0 109.176 178.69 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 61.2 t80 -59.27 -51.07 71.55 Favored 'General case' 0 N--CA 1.453 -0.322 0 C-N-CA 125.403 1.481 . . . . 0.0 108.798 179.073 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 13.8 mm -55.19 -60.32 1.73 Allowed 'Isoleucine or valine' 0 C--O 1.226 -0.132 0 C-N-CA 124.408 1.083 . . . . 0.0 110.163 179.705 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 21.2 ptt180 -59.93 -44.64 94.21 Favored 'General case' 0 C--O 1.219 -0.524 0 CA-C-O 118.366 -0.826 . . . . 0.0 110.499 -179.2 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 18.0 t30 -53.57 -56.73 14.6 Favored 'General case' 0 CA--C 1.519 -0.215 0 CA-C-N 119.374 0.988 . . . . 0.0 110.079 179.875 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -61.42 -33.13 73.19 Favored 'General case' 0 N--CA 1.453 -0.284 0 C-N-CA 124.174 0.99 . . . . 0.0 112.245 -179.81 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -75.5 -24.42 56.85 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 123.441 0.696 . . . . 0.0 112.874 -179.588 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 11.8 mt -98.55 -29.19 13.22 Favored 'General case' 0 N--CA 1.465 0.298 0 C-N-CA 123.583 0.753 . . . . 0.0 111.325 -179.399 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 43.3 m-80 . . . . . 0 C--O 1.243 0.75 0 C-N-CA 126.655 1.982 . . . . 0.0 108.378 -179.846 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' B' B ' 1' ' ' SER . . . . . . . . . . . . . 6.8 t . . . . . 0 CA--C 1.509 -0.612 0 N-CA-C 103.039 -2.948 . . . . 0.0 103.039 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' B' B ' 2' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -140.58 160.95 38.89 Favored 'General case' 0 C--O 1.235 0.34 0 O-C-N 123.418 0.449 . . . . 0.0 110.938 -176.428 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 3' ' ' SER . . . . . . . . . . . . . 17.4 m -110.98 154.79 23.64 Favored 'General case' 0 C--O 1.236 0.38 0 C-N-CA 125.184 1.394 . . . . 0.0 109.308 179.245 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 4' ' ' ALA . . . . . . . . . . . . . . . -133.37 -44.96 0.83 Allowed 'General case' 0 C--O 1.235 0.291 0 C-N-CA 125.297 1.439 . . . . 0.0 109.012 179.5 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 9.7 p -136.12 152.52 30.39 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.315 0 C-N-CA 126.006 1.722 . . . . 0.0 108.553 179.729 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 6' ' ' ARG . . . . . . . . . . . . . 80.3 mtt180 -132.26 -68.84 0.61 Allowed 'General case' 0 C--N 1.332 -0.154 0 N-CA-C 106.119 -1.808 . . . . 0.0 106.119 179.01 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 19.8 pttt -129.4 176.4 7.99 Favored 'General case' 0 C--O 1.235 0.313 0 C-N-CA 124.111 0.965 . . . . 0.0 110.097 179.411 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 17.9 pttt -143.34 -177.44 5.38 Favored 'General case' 0 C--O 1.236 0.385 0 C-N-CA 126.057 1.743 . . . . 0.0 109.5 -179.884 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 6.2 p -160.93 174.73 13.38 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 126.248 1.819 . . . . 0.0 110.151 -178.564 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 10' ' ' GLU . . . . . . . . . . . . . 15.6 tt0 -141.18 2.29 1.69 Allowed 'General case' 0 N--CA 1.469 0.501 0 N-CA-C 115.203 1.557 . . . . 0.0 115.203 -179.618 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 11' ' ' VAL . . . . . . . . . . . . . 14.3 m -116.02 31.43 1.8 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 C-N-CA 125.045 1.338 . . . . 0.0 109.815 179.504 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 12' ' ' ARG . . . . . . . . . . . . . 2.7 tpt180 -151.29 147.93 27.56 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 128.415 2.686 . . . . 0.0 105.095 -179.609 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 13' ' ' GLN . . . . . . . . . . . . . 82.8 mt-30 -116.74 102.77 9.71 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-N 119.851 1.205 . . . . 0.0 109.1 -179.206 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 8.2 ptmt -69.27 -32.17 71.17 Favored 'General case' 0 N--CA 1.464 0.242 0 C-N-CA 123.238 0.615 . . . . 0.0 110.65 179.956 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 4.5 t -72.11 165.49 24.22 Favored 'General case' 0 N--CA 1.442 -0.841 0 N-CA-C 108.852 -0.796 . . . . 0.0 108.852 178.536 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 21.4 t -105.56 120.28 56.1 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.53 0 N-CA-C 104.58 -2.378 . . . . 0.0 104.58 178.674 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 9.4 p -115.59 90.7 1.58 Allowed 'Isoleucine or valine' 0 N--CA 1.447 -0.6 0 N-CA-C 106.233 -1.766 . . . . 0.0 106.233 178.717 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -117.77 161.64 19.37 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 114.234 -1.348 . . . . 0.0 109.185 -179.857 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 56.3 m -104.99 88.68 2.93 Favored 'General case' 0 N--CA 1.448 -0.526 0 N-CA-C 105.155 -2.165 . . . . 0.0 105.155 -179.654 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -90.7 105.6 17.94 Favored 'General case' 0 C--N 1.324 -0.514 0 C-N-CA 125.612 1.565 . . . . 0.0 110.894 -178.47 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 1.4 mpp_? -82.55 154.07 25.21 Favored 'General case' 0 N--CA 1.455 -0.216 0 C-N-CA 123.548 0.739 . . . . 0.0 111.555 178.847 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 22' ' ' PHE . . . . . . . . . . . . . 81.7 m-85 -138.35 141.69 39.7 Favored 'General case' 0 CA--C 1.516 -0.342 0 N-CA-C 106.624 -1.621 . . . . 0.0 106.624 178.129 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 14.5 m -71.61 165.76 46.12 Favored Pre-proline 0 CA--C 1.539 0.556 0 N-CA-C 109.318 -0.623 . . . . 0.0 109.318 179.653 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 24' ' ' PRO . . . . . . . . . . . . . 33.9 Cg_endo -62.36 -38.52 53.04 Favored 'Trans proline' 0 C--N 1.348 0.529 0 C-N-CA 121.457 1.438 . . . . 0.0 111.145 -179.4 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 25' ' ' VAL . . . . . . . . . . . . . 60.5 t -65.42 -49.39 78.71 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.254 0 C-N-CA 124.433 1.093 . . . . 0.0 109.346 179.41 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 54.8 mt-10 -58.96 -49.33 78.26 Favored 'General case' 0 C--O 1.223 -0.335 0 C-N-CA 124.097 0.959 . . . . 0.0 109.743 -179.716 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 27' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -59.83 -39.04 83.73 Favored 'General case' 0 N--CA 1.453 -0.306 0 C-N-CA 124.753 1.221 . . . . 0.0 111.771 -179.832 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 28' ' ' GLU . . . . . . . . . . . . . 12.4 tt0 -66.61 -53.33 35.44 Favored 'General case' 0 N--CA 1.453 -0.315 0 N-CA-C 109.231 -0.655 . . . . 0.0 109.231 179.551 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 64.8 m -57.63 -50.58 72.67 Favored 'General case' 0 N--CA 1.454 -0.251 0 C-N-CA 124.064 0.945 . . . . 0.0 110.02 179.438 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 81.3 mt -60.78 -42.93 94.12 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.354 0 C-N-CA 123.564 0.746 . . . . 0.0 109.275 -179.676 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 56.8 ttt180 -61.42 -51.01 70.52 Favored 'General case' 0 CA--C 1.519 -0.213 0 CA-C-N 119.296 0.953 . . . . 0.0 110.211 179.261 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 5.0 mptp? -60.77 -44.16 97.11 Favored 'General case' 0 CA--C 1.52 -0.195 0 CA-C-N 118.371 0.532 . . . . 0.0 110.388 -179.293 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 34.4 tptt -68.81 -38.99 80.29 Favored 'General case' 0 CA--C 1.528 0.129 0 CA-C-N 118.865 0.757 . . . . 0.0 111.088 -179.631 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 34' ' ' ALA . . . . . . . . . . . . . . . -65.81 -36.25 82.97 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-O 122.577 1.18 . . . . 0.0 109.348 178.825 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 20.6 tt0 -75.7 -19.39 59.14 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 124.137 0.975 . . . . 0.0 110.294 179.433 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 36' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -86.19 -45.55 11.22 Favored 'General case' 0 C--O 1.232 0.169 0 C-N-CA 125.561 1.544 . . . . 0.0 109.856 179.109 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 37' ' ' SER . . . . . . . . . . . . . 48.0 t -79.16 -10.96 59.96 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-O 118.787 -0.625 . . . . 0.0 109.914 -179.911 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 82.39 -7.69 63.75 Favored Glycine 0 C--N 1.338 0.685 0 C-N-CA 124.975 1.274 . . . . 0.0 115.165 178.227 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 39' ' ' LEU . . . . . . . . . . . . . 13.8 mt -96.44 125.48 40.96 Favored 'General case' 0 CA--C 1.518 -0.253 0 CA-C-N 120.235 2.017 . . . . 0.0 105.85 -179.519 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 40' ' ' THR . . . . . . . . . . . . . 5.3 t -45.85 151.32 0.46 Allowed 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 125.202 1.401 . . . . 0.0 110.497 179.851 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 41' ' ' VAL . . . . . . . . . . . . . 53.3 t -45.73 -46.41 4.93 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.218 0 C-N-CA 125.307 1.443 . . . . 0.0 111.772 -179.047 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 42' ' ' SER . . . . . . . . . . . . . 9.6 p -55.55 -45.38 77.27 Favored 'General case' 0 C--O 1.235 0.291 0 O-C-N 121.747 -0.596 . . . . 0.0 112.188 -179.967 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -70.23 -46.74 63.86 Favored 'General case' 0 C--O 1.222 -0.391 0 C-N-CA 124.582 1.153 . . . . 0.0 108.854 178.936 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 44' ' ' TYR . . . . . . . . . . . . . 38.8 t80 -49.61 -50.58 42.23 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 124.626 1.17 . . . . 0.0 109.08 179.662 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 45' ' ' ILE . . . . . . . . . . . . . 21.6 mm -54.44 -61.19 1.04 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.421 0 C-N-CA 124.085 0.954 . . . . 0.0 111.395 179.457 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 46' ' ' ARG . . . . . . . . . . . . . 12.1 ptm180 -59.91 -43.97 94.56 Favored 'General case' 0 N--CA 1.467 0.396 0 O-C-N 121.736 -0.602 . . . . 0.0 111.704 -178.766 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 47' ' ' ASN . . . . . . . . . . . . . 20.6 t30 -56.95 -57.16 13.73 Favored 'General case' 0 N--CA 1.449 -0.509 0 C-N-CA 124.392 1.077 . . . . 0.0 110.76 -179.113 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -61.95 -33.41 74.23 Favored 'General case' 0 N--CA 1.453 -0.281 0 C-N-CA 124.404 1.081 . . . . 0.0 111.708 -179.968 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 49' ' ' ALA . . . . . . . . . . . . . . . -68.56 -42.24 78.64 Favored 'General case' 0 N--CA 1.451 -0.376 0 O-C-N 121.703 -0.623 . . . . 0.0 112.114 -179.11 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 12.5 mt -80.46 -36.03 34.08 Favored 'General case' 0 C--N 1.328 -0.362 0 C-N-CA 123.115 0.566 . . . . 0.0 112.061 -178.844 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 51' ' ' ASN . . . . . . . . . . . . . 46.7 m-80 . . . . . 0 C--O 1.248 1.0 0 CA-C-O 117.362 -1.304 . . . . 0.0 109.769 -179.077 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 15.0 m . . . . . 0 N--CA 1.481 1.09 0 N-CA-C 108.476 -0.935 . . . . 0.0 108.476 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . 0.409 ' CG ' ' H ' ' A' ' 3' ' ' SER . 3.9 p-10 -18.07 -70.55 0.01 OUTLIER 'General case' 0 CA--C 1.537 0.468 1 C-N-CA 134.062 4.945 . . . . 0.0 113.998 176.369 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' SER . . . . . 0.409 ' H ' ' CG ' ' A' ' 2' ' ' ASP . 68.1 m -63.1 26.39 0.01 OUTLIER 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 131.671 3.989 . . . . 0.0 116.125 -178.71 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -48.46 -29.75 4.43 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 125.086 1.354 . . . . 0.0 112.477 179.693 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 19.1 m -50.28 -40.32 17.72 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.492 0 CA-C-N 120.152 1.342 . . . . 0.0 112.178 178.674 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 82.0 mtt85 -61.59 -3.61 1.1 Allowed 'General case' 0 N--CA 1.463 0.218 0 N-CA-C 115.745 1.757 . . . . 0.0 115.745 -178.07 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -118.58 -3.18 10.89 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 120.182 1.355 . . . . 0.0 112.587 178.426 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 6.2 ttpp 175.24 108.27 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.24 0 C-N-CA 127.352 2.261 . . . . 0.0 106.435 179.857 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 15.9 p -151.59 170.1 20.5 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 118.862 0.755 . . . . 0.0 108.998 179.181 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.3 pm0 -96.68 160.62 14.28 Favored 'General case' 0 C--O 1.239 0.502 0 N-CA-C 106.417 -1.698 . . . . 0.0 106.417 177.803 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 14.9 p -112.31 110.25 31.52 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.614 0 CA-C-O 121.682 0.753 . . . . 0.0 109.168 179.832 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 27.3 ptt85 -58.49 110.83 1.05 Allowed 'General case' 0 C--O 1.236 0.388 0 C-N-CA 126.774 2.03 . . . . 0.0 107.155 178.737 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 33.1 mt-30 -77.6 85.14 3.95 Favored 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 123.76 0.824 . . . . 0.0 110.02 -179.148 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 46.0 pttt -66.08 -14.73 62.24 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 123.395 0.678 . . . . 0.0 111.624 178.257 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 14.6 t -74.68 179.47 4.75 Favored 'General case' 0 N--CA 1.446 -0.674 0 N-CA-C 107.048 -1.464 . . . . 0.0 107.048 177.718 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 36.2 t -119.56 129.31 75.49 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.672 0 N-CA-C 104.108 -2.553 . . . . 0.0 104.108 178.92 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 14.3 p -122.0 98.97 6.35 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.515 0 N-CA-C 102.842 -3.021 . . . . 0.0 102.842 178.202 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 62.4 mtt-85 -140.42 164.9 28.88 Favored 'General case' 0 CA--C 1.51 -0.565 0 CA-C-N 115.021 -0.99 . . . . 0.0 110.119 -179.279 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -110.39 148.76 31.37 Favored 'General case' 0 N--CA 1.444 -0.73 0 C-N-CA 125.216 1.406 . . . . 0.0 107.615 179.272 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 58.2 mt -145.09 112.87 6.33 Favored 'General case' 0 CA--C 1.51 -0.558 0 N-CA-C 107.228 -1.397 . . . . 0.0 107.228 178.749 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 14.8 mtm180 -86.42 152.17 22.92 Favored 'General case' 0 C--O 1.238 0.492 0 N-CA-C 107.416 -1.327 . . . . 0.0 107.416 178.052 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 87.7 m-85 -132.8 140.08 47.83 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 105.415 -2.069 . . . . 0.0 105.415 179.58 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -66.76 173.15 2.66 Favored Pre-proline 0 CA--C 1.552 1.037 0 CA-C-N 119.324 0.965 . . . . 0.0 109.53 -179.841 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 28.9 Cg_endo -63.44 -42.29 22.42 Favored 'Trans proline' 0 C--N 1.348 0.517 0 C-N-CA 121.845 1.697 . . . . 0.0 112.983 -178.029 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 38.4 t -67.11 -40.05 84.51 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.306 0 C-N-CA 123.613 0.765 . . . . 0.0 109.653 -179.995 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 -66.26 -44.18 84.35 Favored 'General case' 0 CA--C 1.521 -0.171 0 C-N-CA 124.94 1.296 . . . . 0.0 111.089 -178.791 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 34.5 t70 -61.88 -49.11 77.54 Favored 'General case' 0 CA--C 1.502 -0.89 0 N-CA-C 108.289 -1.004 . . . . 0.0 108.289 179.22 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 44.8 tt0 -52.52 -43.77 65.33 Favored 'General case' 0 N--CA 1.445 -0.714 0 CA-C-O 118.325 -0.845 . . . . 0.0 110.941 179.945 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 32.4 m -65.92 -54.92 20.15 Favored 'General case' 0 CA--C 1.529 0.154 0 CA-C-N 118.837 0.744 . . . . 0.0 109.631 179.185 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 79.9 mt -63.11 -25.6 38.92 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.325 0 CA-C-O 121.724 0.773 . . . . 0.0 111.784 -178.661 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 42.2 ttt180 -77.84 -45.46 24.26 Favored 'General case' 0 C--N 1.316 -0.882 0 O-C-N 119.826 -1.796 . . . . 0.0 107.582 179.526 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 5.6 mptt -68.47 -47.28 67.53 Favored 'General case' 0 CA--C 1.519 -0.22 0 CA-C-O 118.167 -0.92 . . . . 0.0 112.78 179.879 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 29.3 tptt -67.97 -33.67 75.09 Favored 'General case' 0 CA--C 1.523 -0.081 0 CA-C-N 120.407 1.458 . . . . 0.0 111.746 -177.941 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -67.13 -54.88 17.17 Favored 'General case' 0 C--N 1.331 -0.207 0 C-N-CA 125.249 1.42 . . . . 0.0 108.212 179.599 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 22.7 tt0 -60.13 -39.99 88.22 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-N 115.48 -0.782 . . . . 0.0 111.213 -179.143 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -64.95 -41.25 95.66 Favored 'General case' 0 N--CA 1.462 0.126 0 C-N-CA 124.857 1.263 . . . . 0.0 109.984 179.111 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 35.7 m -79.57 -9.05 59.56 Favored 'General case' 0 N--CA 1.448 -0.574 0 C-N-CA 123.741 0.817 . . . . 0.0 112.706 -179.388 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 75.15 13.56 82.63 Favored Glycine 0 CA--C 1.531 1.045 0 CA-C-N 119.377 0.99 . . . . 0.0 113.508 -179.972 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 13.0 mt -115.77 116.43 28.03 Favored 'General case' 0 CA--C 1.511 -0.549 0 N-CA-C 104.379 -2.452 . . . . 0.0 104.379 179.047 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 9.9 t -53.47 157.39 2.11 Favored 'General case' 0 CA--C 1.537 0.449 0 N-CA-C 109.486 -0.561 . . . . 0.0 109.486 179.062 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 61.0 t -45.62 -43.86 4.08 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.206 0 C-N-CA 125.223 1.409 . . . . 0.0 111.551 -179.457 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 97.7 p -59.68 -50.36 74.16 Favored 'General case' 0 CA--C 1.545 0.752 0 CA-C-N 119.44 1.018 . . . . 0.0 111.206 -179.42 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.5 -42.55 98.5 Favored 'General case' 0 C--N 1.339 0.126 0 C-N-CA 124.302 1.041 . . . . 0.0 109.743 179.161 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 67.9 t80 -57.46 -53.33 59.42 Favored 'General case' 0 N--CA 1.45 -0.467 0 N-CA-C 109.335 -0.617 . . . . 0.0 109.335 179.211 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 23.3 mm -54.13 -54.83 17.84 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.152 0 C-N-CA 124.269 1.027 . . . . 0.0 111.372 -179.292 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 13.2 ptt180 -60.78 -50.84 71.83 Favored 'General case' 0 N--CA 1.464 0.266 0 O-C-N 121.609 -0.682 . . . . 0.0 111.397 -179.615 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 22.9 t30 -55.41 -58.37 8.04 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 118.667 -0.682 . . . . 0.0 110.463 -179.562 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -57.14 -31.97 65.89 Favored 'General case' 0 N--CA 1.456 -0.138 0 C-N-CA 124.106 0.963 . . . . 0.0 113.297 -178.934 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -79.81 -33.21 40.61 Favored 'General case' 0 CA--C 1.531 0.248 0 N-CA-C 114.396 1.258 . . . . 0.0 114.396 -179.18 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 13.8 mt -82.98 -33.42 26.62 Favored 'General case' 0 N--CA 1.47 0.53 0 CA-C-N 118.5 0.591 . . . . 0.0 111.316 -178.988 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 3.4 m-80 . . . . . 0 C--O 1.249 1.028 0 C-N-CA 124.646 1.179 . . . . 0.0 108.335 179.107 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' B' B ' 1' ' ' SER . . . . . . . . . . . . . 15.8 m . . . . . 0 N--CA 1.485 1.288 0 N-CA-C 113.402 0.89 . . . . 0.0 113.402 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' B' B ' 2' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -65.52 -177.02 0.39 Allowed 'General case' 0 C--N 1.323 -0.579 1 C-N-CA 136.417 5.887 . . . . 0.0 112.798 -178.302 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 3' ' ' SER . . . . . . . . . . . . . 24.1 m 60.75 10.12 2.52 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 125.744 1.618 . . . . 0.0 114.598 179.643 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 4' ' ' ALA . . . . . . . . . . . . . . . -52.68 -28.22 20.83 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 124.744 1.217 . . . . 0.0 112.408 -179.779 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 14.0 p -49.25 -32.04 5.36 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.567 0 C-N-CA 126.177 1.791 . . . . 0.0 112.537 178.957 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 6' ' ' ARG . . . . . . . . . . . . . 53.9 mtt85 -94.37 -30.83 14.29 Favored 'General case' 0 N--CA 1.47 0.551 0 CA-C-N 119.799 1.182 . . . . 0.0 110.68 178.763 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.81 -38.35 78.42 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-N 119.392 0.996 . . . . 0.0 108.932 179.244 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 18.2 ttmm -159.73 155.48 26.03 Favored 'General case' 0 N--CA 1.454 -0.275 0 N-CA-C 107.384 -1.339 . . . . 0.0 107.384 178.286 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 61.0 p 115.66 145.97 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.504 1 C-N-CA 132.504 4.322 . . . . 0.0 109.991 179.04 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 10' ' ' GLU . . . . . . . . . . . . . 1.6 pm0 -148.39 85.13 1.51 Allowed 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 125.358 1.463 . . . . 0.0 107.868 -179.156 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 11' ' ' VAL . . . . . . . . . . . . . 46.6 t -125.82 81.85 0.74 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.338 0 N-CA-C 108.129 -1.064 . . . . 0.0 108.129 -179.042 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 12' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -145.19 99.97 3.4 Favored 'General case' 0 C--O 1.235 0.324 0 C-N-CA 124.24 1.016 . . . . 0.0 108.301 179.846 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 13' ' ' GLN . . . . . . . . . . . . . 16.9 mt-30 -134.04 35.86 3.28 Favored 'General case' 0 N--CA 1.467 0.394 0 C-N-CA 123.487 0.715 . . . . 0.0 110.134 178.773 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 41.3 pttt -46.93 -24.03 0.54 Allowed 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 127.731 2.412 . . . . 0.0 114.142 179.439 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 12.4 t -75.27 -154.35 0.04 OUTLIER 'General case' 0 N--CA 1.441 -0.883 0 C-N-CA 126.392 1.877 . . . . 0.0 107.35 178.149 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 21.1 t -138.11 152.85 26.32 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.516 0 N-CA-C 106.762 -1.57 . . . . 0.0 106.762 -179.905 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 9.8 p -141.62 104.19 1.3 Allowed 'Isoleucine or valine' 0 N--CA 1.441 -0.891 0 N-CA-C 104.46 -2.422 . . . . 0.0 104.46 177.795 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 30.2 mtt-85 -149.66 152.98 36.28 Favored 'General case' 0 CA--C 1.517 -0.31 0 O-C-N 121.708 -0.62 . . . . 0.0 110.636 -179.323 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 2.3 m -100.36 145.13 28.54 Favored 'General case' 0 C--N 1.327 -0.412 0 C-N-CA 124.909 1.283 . . . . 0.0 108.584 -179.515 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 61.3 mt -134.79 112.84 11.05 Favored 'General case' 0 CA--C 1.52 -0.183 0 N-CA-C 107.699 -1.223 . . . . 0.0 107.699 178.871 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 21.8 mmm-85 -82.52 118.16 23.05 Favored 'General case' 0 C--O 1.233 0.234 0 C-N-CA 124.56 1.144 . . . . 0.0 108.747 179.706 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 22' ' ' PHE . . . . . . . . . . . . . 96.7 m-85 -113.55 155.71 24.92 Favored 'General case' 0 N--CA 1.475 0.808 0 CA-C-N 119.725 1.148 . . . . 0.0 108.421 179.427 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -85.91 168.17 20.75 Favored Pre-proline 0 CA--C 1.541 0.619 0 N-CA-C 107.607 -1.257 . . . . 0.0 107.607 179.509 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 24' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_endo -62.77 -33.21 77.08 Favored 'Trans proline' 0 N--CA 1.459 -0.504 0 C-N-CA 121.611 1.54 . . . . 0.0 112.868 -178.835 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 25' ' ' VAL . . . . . . . . . . . . . 26.3 t -68.25 -57.0 10.57 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.187 0 C-N-CA 124.154 0.982 . . . . 0.0 108.907 179.566 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 2.4 mp0 -55.29 -42.5 73.7 Favored 'General case' 0 CA--C 1.529 0.143 0 C-N-CA 123.568 0.747 . . . . 0.0 110.972 -179.703 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 27' ' ' ASP . . . . . . . . . . . . . 5.0 t70 -63.47 -44.66 93.79 Favored 'General case' 0 C--O 1.224 -0.282 0 C-N-CA 123.476 0.71 . . . . 0.0 109.956 178.776 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 28' ' ' GLU . . . . . . . . . . . . . 19.1 tt0 -58.5 -49.06 78.75 Favored 'General case' 0 N--CA 1.45 -0.464 0 N-CA-C 109.285 -0.635 . . . . 0.0 109.285 179.762 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 88.4 m -58.9 -54.68 44.34 Favored 'General case' 0 N--CA 1.452 -0.362 0 C-N-CA 124.835 1.254 . . . . 0.0 109.686 179.816 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 63.8 mt -59.59 -44.98 94.49 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.132 0 CA-C-N 118.302 0.501 . . . . 0.0 110.461 -179.54 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 77.0 ttt180 -59.08 -47.86 83.71 Favored 'General case' 0 C--O 1.235 0.32 0 C-N-CA 123.4 0.68 . . . . 0.0 110.75 -179.14 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 9.2 mptt -62.85 -50.44 70.93 Favored 'General case' 0 CA--C 1.512 -0.494 0 O-C-N 123.812 0.695 . . . . 0.0 109.621 179.27 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 9.1 tptt -62.23 -38.83 90.71 Favored 'General case' 0 CA--C 1.516 -0.349 0 CA-C-O 118.609 -0.71 . . . . 0.0 112.322 -177.858 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 34' ' ' ALA . . . . . . . . . . . . . . . -58.47 -52.73 64.38 Favored 'General case' 0 N--CA 1.45 -0.439 0 N-CA-C 108.251 -1.018 . . . . 0.0 108.251 178.47 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 11.7 tt0 -68.01 -34.98 77.53 Favored 'General case' 0 CA--C 1.533 0.322 0 N-CA-C 113.003 0.742 . . . . 0.0 113.003 -178.853 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 36' ' ' ASP . . . . . . . . . . . . . 30.3 t70 -65.03 -40.78 95.35 Favored 'General case' 0 C--N 1.332 -0.18 0 C-N-CA 125.122 1.369 . . . . 0.0 108.847 179.389 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 37' ' ' SER . . . . . . . . . . . . . 72.4 m -79.77 -12.89 59.76 Favored 'General case' 0 N--CA 1.45 -0.435 0 C-N-CA 123.09 0.556 . . . . 0.0 110.58 178.459 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 79.07 23.55 63.39 Favored Glycine 0 CA--C 1.523 0.589 0 CA-C-O 118.219 -1.323 . . . . 0.0 114.716 179.012 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 39' ' ' LEU . . . . . . . . . . . . . 33.4 mt -122.55 147.49 46.32 Favored 'General case' 0 N--CA 1.455 -0.213 0 CA-C-N 119.898 1.849 . . . . 0.0 106.106 179.225 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 40' ' ' THR . . . . . . . . . . . . . 5.5 t -64.31 152.46 41.08 Favored 'General case' 0 C--N 1.324 -0.509 0 O-C-N 120.959 -1.088 . . . . 0.0 108.251 179.298 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 41' ' ' VAL . . . . . . . . . . . . . 42.0 t -49.94 -44.84 21.84 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.353 0 O-C-N 121.242 -0.911 . . . . 0.0 110.691 179.399 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 42' ' ' SER . . . . . . . . . . . . . 3.7 p -59.74 -35.6 74.91 Favored 'General case' 0 CA--C 1.542 0.645 0 O-C-N 121.178 -0.951 . . . . 0.0 111.776 -179.863 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -75.93 -43.16 46.33 Favored 'General case' 0 C--O 1.22 -0.489 0 C-N-CA 124.186 0.994 . . . . 0.0 108.595 178.465 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 44' ' ' TYR . . . . . . . . . . . . . 56.3 t80 -55.54 -48.02 75.38 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 124.098 0.959 . . . . 0.0 108.744 178.927 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 45' ' ' ILE . . . . . . . . . . . . . 26.0 mm -61.32 -55.9 21.47 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.151 0 C-N-CA 123.718 0.807 . . . . 0.0 111.72 179.747 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 46' ' ' ARG . . . . . . . . . . . . . 21.0 ptt180 -59.13 -44.04 92.02 Favored 'General case' 0 C--O 1.222 -0.348 0 CA-C-N 118.863 0.756 . . . . 0.0 109.764 -179.259 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 47' ' ' ASN . . . . . . . . . . . . . 15.3 t30 -56.51 -59.65 4.68 Favored 'General case' 0 N--CA 1.451 -0.399 0 C-N-CA 124.24 1.016 . . . . 0.0 110.714 179.916 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -58.58 -31.58 68.15 Favored 'General case' 0 CA--C 1.529 0.158 0 N-CA-C 113.456 0.91 . . . . 0.0 113.456 -178.767 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 49' ' ' ALA . . . . . . . . . . . . . . . -78.91 -34.7 44.43 Favored 'General case' 0 N--CA 1.452 -0.357 0 N-CA-C 113.773 1.027 . . . . 0.0 113.773 -179.368 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 30.7 mt -81.23 -35.15 31.6 Favored 'General case' 0 C--N 1.329 -0.316 0 O-C-N 121.59 -0.694 . . . . 0.0 112.408 -178.976 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 51' ' ' ASN . . . . . . . . . . . . . 35.7 m-80 . . . . . 0 C--O 1.252 1.221 0 CA-C-O 115.936 -1.983 . . . . 0.0 114.86 -179.329 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.471 0.585 0 N-CA-C 104.169 -2.53 . . . . 0.0 104.169 . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 8.5 p-10 -170.22 -174.01 1.63 Allowed 'General case' 0 C--N 1.322 -0.613 0 C-N-CA 129.398 3.079 . . . . 0.0 104.95 -177.498 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 58.9 p -144.3 118.37 9.45 Favored 'General case' 0 N--CA 1.449 -0.524 0 N-CA-C 108.422 -0.955 . . . . 0.0 108.422 178.642 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -64.0 -14.87 57.35 Favored 'General case' 0 CA--C 1.539 0.52 0 O-C-N 121.107 -0.996 . . . . 0.0 111.317 178.952 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 6.8 p -64.75 -17.64 21.94 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.547 0 C-N-CA 125.856 1.662 . . . . 0.0 113.507 179.531 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 23.0 mmm180 -65.4 167.51 8.52 Favored 'General case' 0 CA--C 1.531 0.244 0 CA-C-O 121.964 0.888 . . . . 0.0 112.754 -178.727 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 40.7 ttmt -120.75 68.86 0.87 Allowed 'General case' 0 CA--C 1.529 0.141 0 C-N-CA 126.449 1.899 . . . . 0.0 107.926 179.683 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 58.6 tttp -66.56 -52.06 49.73 Favored 'General case' 0 C--O 1.235 0.317 0 O-C-N 121.51 -0.744 . . . . 0.0 111.244 -179.757 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 31.6 m -78.36 154.15 31.02 Favored 'General case' 0 N--CA 1.45 -0.467 0 CA-C-O 121.155 0.503 . . . . 0.0 110.753 -179.809 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -148.02 -6.9 0.43 Allowed 'General case' 0 C--N 1.328 -0.367 0 C-N-CA 125.651 1.58 . . . . 0.0 112.776 178.277 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 7.7 p -54.87 121.95 3.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 C-N-CA 127.228 2.211 . . . . 0.0 109.564 -179.675 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 25.6 ttp180 50.91 36.15 14.18 Favored 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 123.754 0.822 . . . . 0.0 111.158 179.829 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 30.7 mt-30 59.46 19.69 8.07 Favored 'General case' 0 N--CA 1.47 0.532 0 O-C-N 120.319 -1.488 . . . . 0.0 111.98 -178.41 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 22.1 pttt 44.25 38.82 2.61 Favored 'General case' 0 C--N 1.345 0.412 0 C-N-CA 128.269 2.628 . . . . 0.0 108.684 -178.109 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 2.8 t -160.45 -166.51 1.67 Allowed 'General case' 0 N--CA 1.433 -1.283 0 C-N-CA 124.45 1.1 . . . . 0.0 109.079 -178.415 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 16.0 t -141.74 150.12 19.59 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.53 0 N-CA-C 104.08 -2.563 . . . . 0.0 104.08 178.161 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 14.6 p -145.19 113.94 1.52 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.491 0 N-CA-C 106.677 -1.601 . . . . 0.0 106.677 178.39 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 60.4 ttt-85 -147.83 161.94 40.25 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 106.783 -1.562 . . . . 0.0 106.783 179.465 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -92.99 133.55 36.02 Favored 'General case' 0 N--CA 1.442 -0.834 0 N-CA-C 104.688 -2.338 . . . . 0.0 104.688 178.056 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -115.6 159.33 21.44 Favored 'General case' 0 C--O 1.238 0.488 0 N-CA-C 105.673 -1.973 . . . . 0.0 105.673 178.34 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 17.4 mmt85 -128.91 150.18 50.47 Favored 'General case' 0 CA--C 1.512 -0.505 0 C-N-CA 124.055 0.942 . . . . 0.0 109.565 -179.759 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 90.0 m-85 -142.3 149.83 40.03 Favored 'General case' 0 CA--C 1.515 -0.379 0 N-CA-C 107.568 -1.271 . . . . 0.0 107.568 179.106 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 2.0 m -85.67 -175.62 0.65 Allowed Pre-proline 0 CA--C 1.55 0.965 0 C-N-CA 125.021 1.328 . . . . 0.0 111.091 -179.109 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 39.4 Cg_endo -65.7 -55.06 0.47 Allowed 'Trans proline' 0 C--N 1.357 1.004 0 CA-C-N 121.94 1.729 . . . . 0.0 110.879 -179.485 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 59.9 t -62.0 -40.8 88.61 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.291 0 C-N-CA 123.11 0.564 . . . . 0.0 110.393 -179.772 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -58.46 -50.94 71.92 Favored 'General case' 0 C--O 1.228 -0.051 0 CA-C-N 118.376 0.535 . . . . 0.0 111.597 -179.048 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -65.09 -46.0 82.91 Favored 'General case' 0 CA--C 1.51 -0.563 0 C-N-CA 122.724 0.41 . . . . 0.0 111.311 -179.958 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 39.8 tt0 -54.12 -52.69 60.24 Favored 'General case' 0 N--CA 1.445 -0.708 0 C-N-CA 124.366 1.066 . . . . 0.0 109.69 -179.862 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 22.6 m -63.37 -54.03 43.2 Favored 'General case' 0 N--CA 1.449 -0.493 0 C-N-CA 124.309 1.043 . . . . 0.0 111.034 -179.786 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 34.0 mt -55.55 -44.72 77.46 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.243 0 CA-C-N 118.399 0.545 . . . . 0.0 110.396 -179.331 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 70.1 ttt-85 -62.56 -45.26 93.75 Favored 'General case' 0 C--N 1.33 -0.281 0 C-N-CA 123.179 0.592 . . . . 0.0 110.478 -179.75 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 4.2 mptp? -62.52 -49.21 76.25 Favored 'General case' 0 CA--C 1.517 -0.298 0 C-N-CA 123.085 0.554 . . . . 0.0 109.979 -179.608 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 30.7 tptt -62.12 -50.92 69.97 Favored 'General case' 0 N--CA 1.448 -0.56 0 C-N-CA 122.72 0.408 . . . . 0.0 109.954 -179.331 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -57.0 -47.3 81.15 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 123.824 0.85 . . . . 0.0 111.942 -178.721 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 19.9 tt0 -68.71 -22.46 64.35 Favored 'General case' 0 C--O 1.236 0.394 0 O-C-N 121.147 -0.971 . . . . 0.0 111.018 -179.391 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 24.0 t0 -87.9 -35.73 17.54 Favored 'General case' 0 CA--C 1.522 -0.106 0 C-N-CA 123.635 0.774 . . . . 0.0 110.452 -179.574 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 3.8 t -85.96 -11.43 53.08 Favored 'General case' 0 CA--C 1.536 0.416 0 O-C-N 121.351 -0.843 . . . . 0.0 110.345 179.088 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 86.44 -14.59 54.39 Favored Glycine 0 CA--C 1.527 0.82 0 C-N-CA 125.664 1.602 . . . . 0.0 112.453 -179.669 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 72.2 mt -75.31 112.06 11.21 Favored 'General case' 0 CA--C 1.506 -0.729 0 N-CA-C 105.098 -2.186 . . . . 0.0 105.098 -179.616 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 1.7 t -49.21 152.57 1.15 Allowed 'General case' 0 CA--C 1.538 0.505 0 N-CA-C 108.448 -0.945 . . . . 0.0 108.448 178.645 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 24.3 t -46.5 -35.57 2.61 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.418 0 C-N-CA 125.448 1.499 . . . . 0.0 112.063 -179.326 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -70.84 -47.82 57.27 Favored 'General case' 0 CA--C 1.539 0.535 0 O-C-N 121.337 -0.852 . . . . 0.0 110.325 178.058 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -61.75 -43.3 99.12 Favored 'General case' 0 C--O 1.224 -0.243 0 C-N-CA 124.73 1.212 . . . . 0.0 110.126 179.131 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 61.7 t80 -54.41 -52.89 60.32 Favored 'General case' 0 N--CA 1.449 -0.511 0 C-N-CA 125.247 1.419 . . . . 0.0 109.289 179.658 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 20.8 mm -56.55 -60.15 2.22 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.209 0 C-N-CA 123.306 0.642 . . . . 0.0 112.439 179.657 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 11.8 ptm180 -57.27 -44.45 83.96 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-N 118.277 0.49 . . . . 0.0 111.3 -178.775 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 22.8 t30 -57.91 -53.7 55.23 Favored 'General case' 0 N--CA 1.455 -0.221 0 C-N-CA 123.722 0.809 . . . . 0.0 112.019 -179.508 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -62.45 -34.16 76.25 Favored 'General case' 0 C--N 1.334 -0.074 0 N-CA-C 113.017 0.747 . . . . 0.0 113.017 -179.435 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -70.7 -41.82 71.47 Favored 'General case' 0 N--CA 1.448 -0.525 0 N-CA-C 111.971 0.36 . . . . 0.0 111.971 -178.719 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 17.6 mt -74.58 -40.96 61.3 Favored 'General case' 0 CA--C 1.513 -0.452 0 C-N-CA 123.028 0.531 . . . . 0.0 112.098 -178.623 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 43.8 m-80 . . . . . 0 C--O 1.252 1.221 0 O-C-N 124.194 0.934 . . . . 0.0 108.621 179.765 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B ' 1' ' ' SER . . . . . . . . . . . . . 1.4 t . . . . . 0 N--CA 1.474 0.757 0 N-CA-C 101.935 -3.357 . . . . 0.0 101.935 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B ' 2' ' ' ASP . . . . . . . . . . . . . 6.0 p-10 -170.41 -166.0 0.49 Allowed 'General case' 0 N--CA 1.444 -0.746 0 C-N-CA 126.584 1.954 . . . . 0.0 106.216 -174.949 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 3' ' ' SER . . . . . . . . . . . . . 8.4 m -138.91 172.18 13.23 Favored 'General case' 0 C--N 1.33 -0.268 0 C-N-CA 124.524 1.13 . . . . 0.0 108.934 -179.885 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 4' ' ' ALA . . . . . . . . . . . . . . . -109.31 -3.87 16.85 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 125.151 1.38 . . . . 0.0 112.023 179.979 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 17.1 t -76.02 -28.34 18.79 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.601 0 C-N-CA 124.13 0.972 . . . . 0.0 112.252 -179.171 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 6' ' ' ARG . . . . . . . . . . . . . 26.2 mmm180 -71.7 154.22 41.51 Favored 'General case' 0 C--O 1.237 0.415 0 O-C-N 120.239 -1.538 . . . . 0.0 110.194 -179.376 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 34.5 mtmt -110.81 160.05 17.1 Favored 'General case' 0 C--N 1.329 -0.317 0 C-N-CA 124.711 1.204 . . . . 0.0 107.902 179.117 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 62.4 tttp -138.32 -70.65 0.43 Allowed 'General case' 0 C--O 1.232 0.183 0 C-N-CA 124.031 0.933 . . . . 0.0 108.875 179.714 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 39.2 m -66.34 120.14 12.78 Favored 'General case' 0 N--CA 1.454 -0.265 0 C-N-CA 123.925 0.89 . . . . 0.0 110.152 179.23 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 10' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -115.4 -8.73 12.21 Favored 'General case' 0 C--O 1.236 0.376 0 C-N-CA 127.636 2.374 . . . . 0.0 113.079 179.58 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 11' ' ' VAL . . . . . . . . . . . . . 79.6 t -58.91 135.13 23.68 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 N-CA-C 105.506 -2.035 . . . . 0.0 105.506 179.14 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 12' ' ' ARG . . . . . . . . . . . . . 7.2 ptp180 47.88 24.05 0.54 Allowed 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 125.714 1.606 . . . . 0.0 113.492 -179.477 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 13' ' ' GLN . . . . . . . . . . . . . 39.7 mt-30 61.01 25.88 15.88 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-N 120.607 1.549 . . . . 0.0 110.302 -177.64 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 56.4 pttt 46.08 33.15 1.6 Allowed 'General case' 0 C--N 1.349 0.551 0 C-N-CA 126.795 2.038 . . . . 0.0 109.144 -178.221 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 6.9 t -154.43 -171.92 4.03 Favored 'General case' 0 N--CA 1.432 -1.327 0 CA-C-O 121.845 0.831 . . . . 0.0 111.077 -177.55 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 36.1 t -136.67 145.11 30.83 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.426 0 N-CA-C 104.225 -2.509 . . . . 0.0 104.225 178.856 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 12.3 p -130.93 112.57 22.37 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.697 0 N-CA-C 104.938 -2.245 . . . . 0.0 104.938 178.923 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 4.4 ttt-85 -142.84 146.75 34.44 Favored 'General case' 0 CA--C 1.51 -0.584 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.804 -179.646 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 87.4 m -93.34 117.96 30.71 Favored 'General case' 0 C--O 1.239 0.514 0 N-CA-C 104.715 -2.328 . . . . 0.0 104.715 178.391 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 14.6 tp -120.38 138.54 53.69 Favored 'General case' 0 C--O 1.236 0.395 0 C-N-CA 124.434 1.094 . . . . 0.0 108.869 -178.742 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 11.2 mtt85 -116.15 161.32 19.11 Favored 'General case' 0 CA--C 1.519 -0.24 0 C-N-CA 124.142 0.977 . . . . 0.0 111.562 -179.177 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 22' ' ' PHE . . . . . . . . . . . . . 82.1 m-85 -143.83 157.64 44.23 Favored 'General case' 0 C--N 1.33 -0.258 0 C-N-CA 125.298 1.439 . . . . 0.0 108.019 -179.839 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 50.3 m -79.94 170.44 15.84 Favored Pre-proline 0 CA--C 1.548 0.89 0 C-N-CA 125.241 1.416 . . . . 0.0 107.369 178.344 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 24' ' ' PRO . . . . . . . . . . . . . 60.8 Cg_endo -69.12 -42.82 3.68 Favored 'Trans proline' 0 C--N 1.347 0.448 0 CA-C-N 121.345 1.516 . . . . 0.0 111.063 -178.868 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 25' ' ' VAL . . . . . . . . . . . . . 4.2 t -60.84 -39.16 80.97 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.475 0 C-N-CA 124.013 0.925 . . . . 0.0 108.916 179.762 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 81.3 mt-10 -69.46 -49.78 51.75 Favored 'General case' 0 C--O 1.22 -0.497 0 C-N-CA 123.55 0.74 . . . . 0.0 109.783 179.685 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 27' ' ' ASP . . . . . . . . . . . . . 2.6 t70 -56.09 -43.29 77.9 Favored 'General case' 0 CA--C 1.513 -0.448 0 C-N-CA 124.559 1.144 . . . . 0.0 111.477 179.635 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 28' ' ' GLU . . . . . . . . . . . . . 34.8 tt0 -65.09 -50.44 66.1 Favored 'General case' 0 N--CA 1.445 -0.724 0 O-C-N 123.927 0.767 . . . . 0.0 108.946 179.773 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 60.5 m -58.68 -51.78 68.48 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 122.979 0.512 . . . . 0.0 109.66 179.692 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 83.9 mt -58.45 -43.8 87.5 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.23 0 C-N-CA 124.337 1.055 . . . . 0.0 109.546 -179.803 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 64.9 ttt180 -62.82 -49.57 74.41 Favored 'General case' 0 CA--C 1.519 -0.223 0 O-C-N 121.587 -0.695 . . . . 0.0 110.005 179.737 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 5.1 mptp? -62.28 -42.99 99.82 Favored 'General case' 0 N--CA 1.454 -0.242 0 CA-C-O 118.044 -0.979 . . . . 0.0 110.408 -179.741 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 34.7 tptt -70.37 -37.74 74.63 Favored 'General case' 0 CA--C 1.521 -0.135 0 CA-C-N 119.715 1.143 . . . . 0.0 111.369 -179.413 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 34' ' ' ALA . . . . . . . . . . . . . . . -60.82 -49.12 78.76 Favored 'General case' 0 N--CA 1.453 -0.303 0 N-CA-C 107.259 -1.385 . . . . 0.0 107.259 177.999 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 67.9 tt0 -60.7 -44.64 96.32 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 124.233 1.013 . . . . 0.0 110.863 179.85 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 36' ' ' ASP . . . . . . . . . . . . . 20.8 t70 -62.19 -41.73 98.61 Favored 'General case' 0 CA--C 1.519 -0.214 0 C-N-CA 126.781 2.033 . . . . 0.0 110.19 -179.436 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 37' ' ' SER . . . . . . . . . . . . . 8.0 t -82.16 -10.44 59.17 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 123.058 0.543 . . . . 0.0 111.159 179.527 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 71.41 10.95 71.24 Favored Glycine 0 CA--C 1.533 1.17 0 O-C-N 120.776 -1.203 . . . . 0.0 111.302 -178.761 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 39' ' ' LEU . . . . . . . . . . . . . 27.2 mt -107.07 112.63 25.64 Favored 'General case' 0 N--CA 1.451 -0.399 0 C-N-CA 126.486 1.914 . . . . 0.0 106.173 -179.93 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 40' ' ' THR . . . . . . . . . . . . . 6.4 t -45.51 153.78 0.23 Allowed 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 125.957 1.703 . . . . 0.0 110.156 179.476 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 41' ' ' VAL . . . . . . . . . . . . . 89.4 t -45.62 -45.41 4.49 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.246 0 C-N-CA 124.621 1.168 . . . . 0.0 111.686 -178.683 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 42' ' ' SER . . . . . . . . . . . . . 4.3 p -63.64 -42.92 98.09 Favored 'General case' 0 CA--C 1.541 0.628 0 O-C-N 121.117 -0.989 . . . . 0.0 112.063 179.597 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -65.26 -43.42 91.36 Favored 'General case' 0 C--N 1.34 0.157 0 C-N-CA 125.03 1.332 . . . . 0.0 109.193 178.956 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 44' ' ' TYR . . . . . . . . . . . . . 84.8 t80 -58.1 -52.28 66.21 Favored 'General case' 0 N--CA 1.448 -0.527 0 C-N-CA 125.26 1.424 . . . . 0.0 108.497 179.298 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 45' ' ' ILE . . . . . . . . . . . . . 16.8 mm -57.51 -62.61 0.87 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.393 0 C-N-CA 123.961 0.904 . . . . 0.0 111.261 179.81 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 46' ' ' ARG . . . . . . . . . . . . . 9.0 ptm180 -53.59 -41.17 66.31 Favored 'General case' 0 C--O 1.224 -0.287 0 CA-C-O 118.057 -0.973 . . . . 0.0 112.558 -178.664 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 47' ' ' ASN . . . . . . . . . . . . . 16.1 t30 -70.62 -52.2 22.96 Favored 'General case' 0 N--CA 1.453 -0.321 0 C-N-CA 124.502 1.121 . . . . 0.0 111.187 -179.348 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -58.4 -31.45 67.71 Favored 'General case' 0 CA--C 1.53 0.178 0 C-N-CA 122.908 0.483 . . . . 0.0 112.016 -179.175 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 49' ' ' ALA . . . . . . . . . . . . . . . -74.83 -21.05 59.5 Favored 'General case' 0 N--CA 1.445 -0.686 0 N-CA-C 114.761 1.393 . . . . 0.0 114.761 -179.476 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 10.8 mt -105.38 -34.84 7.71 Favored 'General case' 0 N--CA 1.469 0.52 0 N-CA-C 113.757 1.021 . . . . 0.0 113.757 -178.391 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 51' ' ' ASN . . . . . . . . . . . . . 26.3 m-80 . . . . . 0 C--O 1.252 1.232 0 CA-C-O 116.214 -1.85 . . . . 0.0 113.528 -178.307 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 1.4 p . . . . . 0 CA--C 1.51 -0.573 0 N-CA-C 103.662 -2.718 . . . . 0.0 103.662 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 12.0 t70 -74.58 160.68 30.55 Favored 'General case' 0 C--O 1.24 0.598 0 N-CA-C 105.519 -2.03 . . . . 0.0 105.519 176.182 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 70.1 m -143.0 93.83 2.55 Favored 'General case' 0 N--CA 1.443 -0.777 0 N-CA-C 104.16 -2.533 . . . . 0.0 104.16 179.109 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -53.47 -8.62 0.15 Allowed 'General case' 0 C--O 1.243 0.755 0 N-CA-C 116.452 2.019 . . . . 0.0 116.452 -178.834 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 11.3 p -62.37 141.69 17.54 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.346 0 N-CA-C 106.604 -1.628 . . . . 0.0 106.604 178.294 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -144.33 164.06 31.9 Favored 'General case' 0 C--O 1.236 0.386 0 O-C-N 120.517 -1.364 . . . . 0.0 110.961 -179.48 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -87.21 178.51 6.86 Favored 'General case' 0 C--O 1.237 0.431 0 N-CA-C 107.7 -1.222 . . . . 0.0 107.7 178.338 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 35.4 pttt -152.36 -178.9 7.1 Favored 'General case' 0 C--N 1.321 -0.649 0 C-N-CA 126.952 2.101 . . . . 0.0 105.652 178.551 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 50.3 p -132.18 135.09 46.09 Favored 'General case' 0 N--CA 1.442 -0.852 0 N-CA-C 105.348 -2.093 . . . . 0.0 105.348 178.67 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.7 pm0 -123.06 5.04 9.29 Favored 'General case' 0 C--N 1.323 -0.544 0 C-N-CA 124.874 1.27 . . . . 0.0 110.391 179.805 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 1.3 m -71.43 -50.74 38.34 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.289 0 C-N-CA 126.319 1.847 . . . . 0.0 111.673 179.074 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 13.4 ttm180 -68.91 156.78 37.9 Favored 'General case' 0 C--O 1.236 0.373 0 C-N-CA 123.795 0.838 . . . . 0.0 111.443 -178.214 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 8.1 pt20 -87.87 66.51 8.76 Favored 'General case' 0 C--N 1.331 -0.197 0 N-CA-C 107.648 -1.242 . . . . 0.0 107.648 178.242 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 14.8 pttm -64.51 -41.4 96.43 Favored 'General case' 0 C--O 1.225 -0.204 0 N-CA-C 108.43 -0.952 . . . . 0.0 108.43 178.991 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 11.4 t -65.48 148.28 51.98 Favored 'General case' 0 N--CA 1.439 -1.025 0 N-CA-C 107.305 -1.369 . . . . 0.0 107.305 177.995 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 2.3 p -80.2 148.8 5.49 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.01 0 N-CA-C 105.515 -2.032 . . . . 0.0 105.515 178.245 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 13.1 p -144.81 114.0 1.68 Allowed 'Isoleucine or valine' 0 N--CA 1.441 -0.914 0 N-CA-C 107.541 -1.281 . . . . 0.0 107.541 177.692 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 17.0 ttt85 -145.47 177.72 8.64 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 106.57 -1.641 . . . . 0.0 106.57 178.951 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 29.5 m -128.35 139.69 52.25 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 104.346 -2.464 . . . . 0.0 104.346 179.156 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 77.8 mt -120.16 169.08 10.57 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-N 118.626 0.648 . . . . 0.0 109.764 179.605 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 12.3 mmt-85 -137.81 136.09 36.89 Favored 'General case' 0 C--O 1.237 0.397 0 C-N-CA 126.281 1.832 . . . . 0.0 109.38 -179.975 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . 0.44 ' H ' HG11 ' B' ' 16' ' ' VAL . 24.6 m-85 -133.95 152.58 51.91 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 106.715 -1.587 . . . . 0.0 106.715 178.76 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 4.9 m -69.04 166.93 23.43 Favored Pre-proline 0 CA--C 1.543 0.681 0 N-CA-C 107.734 -1.21 . . . . 0.0 107.734 178.929 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 19.5 Cg_endo -56.84 -48.62 17.66 Favored 'Trans proline' 0 N--CA 1.461 -0.425 0 C-N-CA 121.801 1.667 . . . . 0.0 112.21 -178.975 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 98.0 t -59.94 -43.67 92.81 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.471 0 C-N-CA 126.171 1.788 . . . . 0.0 110.722 179.861 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 88.0 mt-10 -67.39 -46.05 74.43 Favored 'General case' 0 C--N 1.334 -0.076 0 C-N-CA 124.991 1.316 . . . . 0.0 110.7 -178.827 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 30.5 t70 -62.4 -42.11 99.18 Favored 'General case' 0 CA--C 1.519 -0.213 0 N-CA-C 109.12 -0.696 . . . . 0.0 109.12 179.443 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 16.5 tt0 -66.28 -37.03 84.5 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 124.298 1.039 . . . . 0.0 109.79 178.883 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 95.3 m -64.35 -55.05 23.8 Favored 'General case' 0 CA--C 1.531 0.224 0 N-CA-C 106.949 -1.5 . . . . 0.0 106.949 178.68 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 75.1 mt -56.46 -45.68 81.95 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.247 0 C-N-CA 124.219 1.008 . . . . 0.0 108.987 -179.882 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 74.6 ttt180 -59.95 -47.54 85.38 Favored 'General case' 0 N--CA 1.457 -0.091 0 C-N-CA 123.511 0.724 . . . . 0.0 110.966 -179.785 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 11.7 mptt -64.02 -48.73 75.16 Favored 'General case' 0 CA--C 1.522 -0.109 0 CA-C-O 118.15 -0.928 . . . . 0.0 110.647 -179.792 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 24.9 mmtp -60.6 -46.12 91.42 Favored 'General case' 0 N--CA 1.463 0.213 0 CA-C-N 119.019 0.827 . . . . 0.0 109.915 -179.539 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -56.93 -55.28 36.63 Favored 'General case' 0 N--CA 1.454 -0.23 0 C-N-CA 124.013 0.925 . . . . 0.0 110.286 179.787 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 27.5 tt0 -64.43 -35.07 79.72 Favored 'General case' 0 N--CA 1.455 -0.21 0 CA-C-O 119.072 -0.49 . . . . 0.0 112.193 -178.761 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 41.8 t0 -66.21 -39.74 89.85 Favored 'General case' 0 N--CA 1.466 0.325 0 N-CA-C 107.838 -1.171 . . . . 0.0 107.838 179.484 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 22.9 t -75.57 -10.63 59.61 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 125.482 1.513 . . . . 0.0 110.211 178.374 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 73.06 4.15 62.3 Favored Glycine 0 CA--C 1.531 1.068 0 C-N-CA 125.551 1.548 . . . . 0.0 113.962 -179.984 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 12.9 mt -106.34 128.03 53.7 Favored 'General case' 0 CA--C 1.51 -0.584 0 N-CA-C 105.414 -2.069 . . . . 0.0 105.414 179.749 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 8.7 t -50.82 152.43 2.1 Favored 'General case' 0 CA--C 1.539 0.546 0 CA-C-O 121.435 0.636 . . . . 0.0 110.571 179.256 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 52.0 t -46.63 -40.49 4.55 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.166 0 C-N-CA 126.089 1.756 . . . . 0.0 111.908 -179.78 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 3.5 p -61.46 -42.58 99.0 Favored 'General case' 0 CA--C 1.535 0.365 0 CA-C-N 119.567 1.076 . . . . 0.0 111.37 -179.732 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -70.65 -42.13 71.23 Favored 'General case' 0 C--O 1.222 -0.391 0 N-CA-C 108.527 -0.916 . . . . 0.0 108.527 178.343 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 56.0 t80 -55.08 -51.5 66.19 Favored 'General case' 0 CA--C 1.535 0.396 0 CA-C-N 118.838 0.745 . . . . 0.0 109.083 179.235 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 18.1 mm -56.83 -61.44 1.23 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.19 0 C-N-CA 125.173 1.389 . . . . 0.0 110.207 179.686 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 11.8 ptt180 -51.58 -44.3 62.73 Favored 'General case' 0 C--O 1.222 -0.377 0 C-N-CA 123.655 0.782 . . . . 0.0 110.738 -179.135 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 2.2 t30 -62.07 -56.85 14.81 Favored 'General case' 0 N--CA 1.452 -0.338 0 C-N-CA 123.882 0.873 . . . . 0.0 110.031 179.016 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -59.12 -32.05 69.49 Favored 'General case' 0 C--O 1.224 -0.256 0 N-CA-C 113.521 0.934 . . . . 0.0 113.521 -178.645 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -76.28 -24.5 54.45 Favored 'General case' 0 CA--C 1.533 0.322 0 N-CA-C 113.696 0.999 . . . . 0.0 113.696 -179.485 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 17.9 mt -97.46 -28.3 14.05 Favored 'General case' 0 N--CA 1.466 0.339 0 C-N-CA 123.18 0.592 . . . . 0.0 110.288 179.62 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 43.1 m-80 . . . . . 0 C--O 1.253 1.276 0 C-N-CA 125.521 1.528 . . . . 0.0 108.335 179.133 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' B' B ' 1' ' ' SER . . . . . . . . . . . . . 1.5 p . . . . . 0 CA--C 1.51 -0.562 0 N-CA-C 103.874 -2.639 . . . . 0.0 103.874 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' B' B ' 2' ' ' ASP . . . . . . . . . . . . . 11.8 t70 -75.3 162.84 28.07 Favored 'General case' 0 C--O 1.241 0.638 0 N-CA-C 105.87 -1.9 . . . . 0.0 105.87 176.379 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 3' ' ' SER . . . . . . . . . . . . . 74.7 m -139.61 85.61 2.06 Favored 'General case' 0 N--CA 1.446 -0.643 0 N-CA-C 104.088 -2.56 . . . . 0.0 104.088 179.079 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 4' ' ' ALA . . . . . . . . . . . . . . . -62.33 76.3 0.02 OUTLIER 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 126.129 1.772 . . . . 0.0 113.832 -178.836 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 9.1 p -144.22 148.05 18.91 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.309 0 N-CA-C 105.635 -1.987 . . . . 0.0 105.635 178.733 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 6' ' ' ARG . . . . . . . . . . . . . 9.1 ptm180 -148.87 137.43 21.18 Favored 'General case' 0 C--O 1.236 0.359 0 O-C-N 120.568 -1.333 . . . . 0.0 110.313 -179.038 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.65 165.24 25.46 Favored 'General case' 0 C--O 1.236 0.387 0 N-CA-C 108.923 -0.769 . . . . 0.0 108.923 179.366 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 25.9 pttm -128.56 -177.4 4.16 Favored 'General case' 0 C--N 1.328 -0.35 0 C-N-CA 125.226 1.41 . . . . 0.0 110.046 179.871 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 3.3 p -120.11 85.7 2.43 Favored 'General case' 0 N--CA 1.454 -0.253 0 C-N-CA 124.683 1.193 . . . . 0.0 108.513 -179.802 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 10' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -70.87 -12.9 61.82 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 114.235 1.198 . . . . 0.0 114.235 -179.753 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 11' ' ' VAL . . . . . . . . . . . . . 31.6 t -78.09 -52.78 15.33 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 C-N-CA 124.243 1.017 . . . . 0.0 108.626 179.83 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 12' ' ' ARG . . . . . . . . . . . . . 15.9 ttm180 -59.35 138.62 57.57 Favored 'General case' 0 C--N 1.343 0.307 0 N-CA-C 109.048 -0.723 . . . . 0.0 109.048 -179.564 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 13' ' ' GLN . . . . . . . . . . . . . 20.4 pt20 -73.44 71.28 1.29 Allowed 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 125.221 1.409 . . . . 0.0 111.904 179.613 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 22.3 pttm -59.2 -31.14 68.75 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 123.509 0.723 . . . . 0.0 110.903 178.606 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 5.5 t -70.08 -167.71 0.17 Allowed 'General case' 0 N--CA 1.443 -0.8 0 C-N-CA 126.595 1.958 . . . . 0.0 110.711 179.157 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 16' ' ' VAL . . . . . 0.44 HG11 ' H ' ' A' ' 22' ' ' PHE . 0.3 OUTLIER -130.24 148.46 33.16 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.794 0 N-CA-C 102.209 -3.256 . . . . 0.0 102.209 178.316 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 9.3 p -147.08 98.79 0.41 Allowed 'Isoleucine or valine' 0 N--CA 1.436 -1.173 0 N-CA-C 104.559 -2.386 . . . . 0.0 104.559 179.201 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 16.8 ttt85 -138.74 152.37 47.91 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.105 -0.952 . . . . 0.0 110.945 -179.265 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 19.6 m -91.73 135.89 33.56 Favored 'General case' 0 C--N 1.326 -0.435 0 C-N-CA 125.316 1.446 . . . . 0.0 108.195 179.92 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -139.09 134.82 33.43 Favored 'General case' 0 C--O 1.237 0.407 0 N-CA-C 108.84 -0.8 . . . . 0.0 108.84 179.085 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 50.1 mtm-85 -115.67 159.1 21.79 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 124.475 1.11 . . . . 0.0 110.798 179.363 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 22' ' ' PHE . . . . . . . . . . . . . 31.9 m-85 -145.43 154.24 42.04 Favored 'General case' 0 C--O 1.238 0.45 0 C-N-CA 125.398 1.479 . . . . 0.0 108.18 179.98 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 15.4 m -67.85 168.01 14.55 Favored Pre-proline 0 CA--C 1.537 0.46 0 N-CA-C 108.568 -0.901 . . . . 0.0 108.568 178.82 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 24' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -63.09 -42.19 24.6 Favored 'Trans proline' 0 N--CA 1.457 -0.63 0 CA-C-N 120.291 1.14 . . . . 0.0 109.329 179.356 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 25' ' ' VAL . . . . . . . . . . . . . 75.6 t -57.07 -44.75 83.53 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.585 0 C-N-CA 123.797 0.839 . . . . 0.0 109.637 178.925 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 49.3 mt-10 -66.23 -52.19 50.23 Favored 'General case' 0 N--CA 1.454 -0.23 0 C-N-CA 124.355 1.062 . . . . 0.0 110.392 -179.785 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 27' ' ' ASP . . . . . . . . . . . . . 34.9 t70 -60.27 -39.81 88.16 Favored 'General case' 0 C--O 1.223 -0.295 0 C-N-CA 123.692 0.797 . . . . 0.0 111.471 -179.237 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 28' ' ' GLU . . . . . . . . . . . . . 79.6 mt-10 -63.92 -50.91 66.85 Favored 'General case' 0 N--CA 1.453 -0.311 0 N-CA-C 107.616 -1.253 . . . . 0.0 107.616 178.506 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 90.2 m -55.1 -58.96 5.53 Favored 'General case' 0 CA--C 1.531 0.219 0 N-CA-C 109.104 -0.702 . . . . 0.0 109.104 179.618 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 92.9 mt -55.06 -47.03 77.53 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.353 0 C-N-CA 124.29 1.036 . . . . 0.0 110.132 -179.286 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 61.7 ttt180 -58.9 -48.83 80.05 Favored 'General case' 0 CA--C 1.52 -0.207 0 CA-C-N 119.093 0.861 . . . . 0.0 110.542 -179.752 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 10.6 mptt -61.7 -49.18 77.49 Favored 'General case' 0 C--O 1.22 -0.466 0 CA-C-O 118.546 -0.74 . . . . 0.0 109.889 -179.248 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 22.8 mmtp -56.71 -49.79 74.1 Favored 'General case' 0 CA--C 1.517 -0.319 0 C-N-CA 124.32 1.048 . . . . 0.0 109.574 -178.664 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 34' ' ' ALA . . . . . . . . . . . . . . . -56.19 -58.58 7.36 Favored 'General case' 0 N--CA 1.446 -0.646 0 C-N-CA 125.858 1.663 . . . . 0.0 110.5 179.967 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 11.6 tt0 -67.38 -20.21 65.52 Favored 'General case' 0 N--CA 1.467 0.391 0 N-CA-C 113.599 0.963 . . . . 0.0 113.599 -177.796 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 36' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -92.15 2.96 56.27 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 126.401 1.88 . . . . 0.0 110.7 178.884 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 37' ' ' SER . . . . . . . . . . . . . 18.6 t -122.59 -6.35 8.65 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 125.779 1.632 . . . . 0.0 111.021 -179.921 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 73.87 31.5 60.07 Favored Glycine 0 CA--C 1.527 0.783 0 N-CA-C 110.176 -1.169 . . . . 0.0 110.176 -179.455 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 39' ' ' LEU . . . . . . . . . . . . . 59.6 mt -128.19 129.56 46.66 Favored 'General case' 0 N--CA 1.446 -0.637 0 C-N-CA 125.959 1.704 . . . . 0.0 108.83 -178.491 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 40' ' ' THR . . . . . . . . . . . . . 1.8 t -66.59 152.4 45.37 Favored 'General case' 0 CA--C 1.541 0.611 0 N-CA-C 104.344 -2.465 . . . . 0.0 104.344 176.626 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 41' ' ' VAL . . . . . . . . . . . . . 55.0 t -47.58 -40.94 7.6 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.338 0 C-N-CA 124.596 1.158 . . . . 0.0 111.118 179.157 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 42' ' ' SER . . . . . . . . . . . . . 5.1 p -61.77 -44.21 97.33 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-N 120.007 1.276 . . . . 0.0 111.08 179.598 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -65.76 -40.53 92.13 Favored 'General case' 0 C--O 1.226 -0.18 0 C-N-CA 124.008 0.923 . . . . 0.0 109.059 178.776 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 44' ' ' TYR . . . . . . . . . . . . . 53.4 t80 -60.64 -52.64 64.28 Favored 'General case' 0 CA--C 1.534 0.35 0 N-CA-C 108.114 -1.069 . . . . 0.0 108.114 178.904 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 45' ' ' ILE . . . . . . . . . . . . . 23.2 mm -54.53 -62.19 0.8 Allowed 'Isoleucine or valine' 0 C--N 1.34 0.169 0 C-N-CA 124.537 1.135 . . . . 0.0 110.672 -179.888 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 46' ' ' ARG . . . . . . . . . . . . . 22.2 ptt180 -54.75 -47.03 74.34 Favored 'General case' 0 C--O 1.223 -0.291 0 CA-C-O 119.302 -0.38 . . . . 0.0 111.711 -178.856 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 47' ' ' ASN . . . . . . . . . . . . . 23.7 t30 -61.08 -52.04 66.62 Favored 'General case' 0 N--CA 1.448 -0.528 0 CA-C-O 118.282 -0.866 . . . . 0.0 111.132 -178.814 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -63.42 -27.86 69.58 Favored 'General case' 0 C--O 1.225 -0.223 0 C-N-CA 124.038 0.935 . . . . 0.0 112.075 179.776 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 49' ' ' ALA . . . . . . . . . . . . . . . -77.75 -34.8 52.29 Favored 'General case' 0 N--CA 1.457 -0.082 0 O-C-N 121.391 -0.818 . . . . 0.0 111.692 -179.914 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 38.1 mt -82.51 -46.16 13.77 Favored 'General case' 0 C--N 1.33 -0.249 0 C-N-CA 122.874 0.469 . . . . 0.0 110.629 -179.06 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 51' ' ' ASN . . . . . . . . . . . . . 42.5 m-80 . . . . . 0 C--O 1.248 0.981 0 C-N-CA 124.768 1.227 . . . . 0.0 110.668 -179.721 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 24.5 m . . . . . 0 N--CA 1.477 0.894 0 CA-C-O 121.499 0.666 . . . . 0.0 111.378 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -45.08 22.83 0.0 OUTLIER 'General case' 0 CA--C 1.538 0.498 1 C-N-CA 142.357 8.263 . . . . 0.0 115.89 -179.49 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 23.3 p -66.24 61.52 0.04 OUTLIER 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 129.754 3.222 . . . . 0.0 112.87 -179.725 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -55.92 -18.65 9.57 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 125.87 1.668 . . . . 0.0 115.355 -179.129 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 14.5 p -51.02 -32.71 12.28 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.45 0 C-N-CA 125.4 1.48 . . . . 0.0 114.563 -179.255 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 48.9 ttp180 -139.57 127.19 21.75 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 119.513 1.051 . . . . 0.0 110.077 -179.41 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 72.3 mttt -68.98 -67.03 0.5 Allowed 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 123.39 0.676 . . . . 0.0 109.794 179.277 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 37.6 mtpt -140.94 179.83 6.49 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 125.005 1.322 . . . . 0.0 108.631 179.391 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 5.1 t -141.5 117.5 10.56 Favored 'General case' 0 N--CA 1.453 -0.311 0 N-CA-C 106.209 -1.775 . . . . 0.0 106.209 179.461 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 13.3 pt-20 -117.68 1.77 12.23 Favored 'General case' 0 N--CA 1.473 0.715 0 N-CA-C 113.522 0.934 . . . . 0.0 113.522 -179.438 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 11.9 m -63.64 136.04 26.81 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.331 0 C-N-CA 124.126 0.97 . . . . 0.0 109.859 179.678 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 4.3 mmp_? -89.0 -32.86 17.4 Favored 'General case' 0 CA--C 1.517 -0.296 0 N-CA-C 113.189 0.811 . . . . 0.0 113.189 -178.98 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 82.5 mt-30 -76.41 96.79 4.11 Favored 'General case' 0 N--CA 1.454 -0.246 0 CA-C-O 121.651 0.738 . . . . 0.0 110.217 -178.885 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 21.2 ptmt -66.36 -33.1 74.96 Favored 'General case' 0 N--CA 1.462 0.159 0 N-CA-C 109.591 -0.522 . . . . 0.0 109.591 178.825 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 4.2 t -78.99 168.04 20.25 Favored 'General case' 0 N--CA 1.44 -0.941 0 C-N-CA 124.84 1.256 . . . . 0.0 108.793 179.306 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 95.2 t -97.86 145.34 9.66 Favored 'Isoleucine or valine' 0 CA--C 1.505 -0.755 0 C-N-CA 126.747 2.019 . . . . 0.0 105.918 179.308 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 7.8 p -145.62 99.95 0.51 Allowed 'Isoleucine or valine' 0 N--CA 1.441 -0.908 0 CA-C-O 122.6 1.191 . . . . 0.0 108.484 178.066 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 26.4 mtt-85 -143.12 157.39 44.56 Favored 'General case' 0 CA--C 1.511 -0.531 0 CA-C-N 115.084 -0.962 . . . . 0.0 110.234 178.824 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 96.6 m -86.42 100.5 12.39 Favored 'General case' 0 N--CA 1.446 -0.671 0 N-CA-C 106.664 -1.606 . . . . 0.0 106.664 179.548 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -95.4 86.68 4.57 Favored 'General case' 0 C--N 1.323 -0.579 0 C-N-CA 126.806 2.042 . . . . 0.0 107.321 -179.27 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 14.0 mtp180 -77.36 162.51 27.21 Favored 'General case' 0 N--CA 1.453 -0.316 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.64 179.246 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 92.7 m-85 -139.8 171.08 14.73 Favored 'General case' 0 CA--C 1.516 -0.349 0 C-N-CA 125.966 1.707 . . . . 0.0 108.068 178.985 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 7.7 m -106.2 172.56 3.83 Favored Pre-proline 0 CA--C 1.547 0.848 0 N-CA-C 108.063 -1.088 . . . . 0.0 108.063 179.306 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 92.5 Cg_endo -70.67 -33.99 12.27 Favored 'Trans proline' 0 N--CA 1.46 -0.482 0 CA-C-N 122.163 1.808 . . . . 0.0 113.341 -177.545 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 35.7 t -77.31 -36.3 23.77 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.31 0 N-CA-C 107.209 -1.404 . . . . 0.0 107.209 179.187 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 73.9 mt-10 -61.28 -54.1 48.35 Favored 'General case' 0 C--N 1.343 0.285 0 N-CA-C 107.523 -1.288 . . . . 0.0 107.523 178.709 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -57.34 -46.53 83.2 Favored 'General case' 0 C--O 1.217 -0.623 0 C-N-CA 125.068 1.347 . . . . 0.0 111.181 -179.838 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 13.3 tt0 -58.37 -51.38 70.07 Favored 'General case' 0 N--CA 1.452 -0.33 0 CA-C-O 118.726 -0.654 . . . . 0.0 111.204 179.745 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 85.5 m -57.33 -52.5 65.12 Favored 'General case' 0 CA--C 1.536 0.423 0 CA-C-N 118.766 0.712 . . . . 0.0 109.52 179.454 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 96.0 mt -56.89 -47.53 82.94 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.178 0 C-N-CA 123.392 0.677 . . . . 0.0 110.356 -179.299 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 33.1 ttt85 -61.78 -44.83 96.12 Favored 'General case' 0 N--CA 1.448 -0.545 0 C-N-CA 123.875 0.87 . . . . 0.0 111.769 -179.082 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 14.0 mptt -59.17 -51.22 70.95 Favored 'General case' 0 CA--C 1.516 -0.33 0 CA-C-N 118.549 0.613 . . . . 0.0 109.649 179.469 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 4.6 mptp? -62.9 -47.18 84.4 Favored 'General case' 0 CA--C 1.515 -0.379 0 CA-C-O 118.135 -0.936 . . . . 0.0 110.637 -179.01 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -56.15 -55.48 32.6 Favored 'General case' 0 N--CA 1.451 -0.391 0 C-N-CA 124.217 1.007 . . . . 0.0 109.776 179.505 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 5.3 tt0 -60.25 -38.65 84.13 Favored 'General case' 0 C--O 1.234 0.241 0 O-C-N 123.54 0.525 . . . . 0.0 111.545 -178.113 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -72.08 -24.93 61.58 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 123.872 0.869 . . . . 0.0 111.196 179.458 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 2.2 t -83.52 -8.15 59.4 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 126.477 1.911 . . . . 0.0 109.023 178.129 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 77.88 8.66 87.27 Favored Glycine 0 CA--C 1.529 0.957 0 CA-C-O 118.812 -0.994 . . . . 0.0 111.716 -179.029 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 40.1 mt -116.55 154.98 29.47 Favored 'General case' 0 N--CA 1.452 -0.344 0 CA-C-N 119.758 1.779 . . . . 0.0 111.457 -178.435 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -74.99 151.61 38.78 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 104.116 -2.549 . . . . 0.0 104.116 176.159 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 19.4 m -51.2 -31.29 11.06 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.929 0 CA-C-N 114.873 -1.058 . . . . 0.0 110.937 178.93 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 29.3 t -61.0 -58.94 6.32 Favored 'General case' 0 CA--C 1.536 0.435 0 CA-C-N 119.421 1.009 . . . . 0.0 108.936 178.549 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -58.98 -39.52 82.02 Favored 'General case' 0 C--O 1.223 -0.3 0 C-N-CA 123.662 0.785 . . . . 0.0 109.385 178.78 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 77.8 t80 -60.78 -50.19 74.45 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-O 119.084 -0.484 . . . . 0.0 109.737 179.059 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 10.8 mm -55.6 -62.96 0.66 Allowed 'Isoleucine or valine' 0 N--CA 1.463 0.182 0 C-N-CA 125.272 1.429 . . . . 0.0 109.904 179.99 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 27.3 ptt180 -53.08 -44.09 67.28 Favored 'General case' 0 N--CA 1.454 -0.271 0 C-N-CA 123.293 0.637 . . . . 0.0 110.708 -178.579 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 39.1 t30 -63.2 -55.98 20.5 Favored 'General case' 0 N--CA 1.45 -0.444 0 C-N-CA 123.502 0.721 . . . . 0.0 111.583 -179.798 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -61.35 -28.35 69.16 Favored 'General case' 0 N--CA 1.463 0.223 0 C-N-CA 123.965 0.906 . . . . 0.0 112.096 -178.91 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -74.93 -27.62 60.28 Favored 'General case' 0 N--CA 1.453 -0.281 0 N-CA-C 113.022 0.749 . . . . 0.0 113.022 -179.468 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 13.7 mt -93.83 -44.64 8.02 Favored 'General case' 0 C--N 1.332 -0.193 0 C-N-CA 122.849 0.46 . . . . 0.0 110.747 -179.378 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 79.1 m-20 . . . . . 0 C--O 1.244 0.789 0 C-N-CA 124.622 1.169 . . . . 0.0 111.249 -178.229 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' B' B ' 1' ' ' SER . . . . . . . . . . . . . 20.4 m . . . . . 0 N--CA 1.478 0.958 0 CA-C-O 121.758 0.79 . . . . 0.0 111.46 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' B' B ' 2' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -46.45 31.73 0.0 OUTLIER 'General case' 0 CA--C 1.536 0.414 1 C-N-CA 142.201 8.2 . . . . 0.0 114.608 -179.657 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 3' ' ' SER . . . . . . . . . . . . . 16.8 p -67.27 63.62 0.06 Allowed 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 128.924 2.89 . . . . 0.0 114.121 -178.89 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 4' ' ' ALA . . . . . . . . . . . . . . . -58.19 -18.36 25.36 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 124.449 1.099 . . . . 0.0 112.481 179.356 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 4.5 m -55.35 -28.0 21.36 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.412 0 C-N-CA 126.916 2.086 . . . . 0.0 114.178 179.625 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 6' ' ' ARG . . . . . . . . . . . . . 58.9 ttp180 -149.81 130.86 14.39 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-N 120.94 1.7 . . . . 0.0 110.127 -179.448 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 59.3 mttt -74.17 -63.32 1.25 Allowed 'General case' 0 N--CA 1.465 0.305 0 CA-C-O 118.242 -0.885 . . . . 0.0 111.3 179.98 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 23.5 mtpt -144.3 -178.28 5.89 Favored 'General case' 0 N--CA 1.471 0.601 0 CA-C-N 120.324 1.42 . . . . 0.0 109.565 179.775 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -151.94 113.7 4.4 Favored 'General case' 0 N--CA 1.454 -0.251 0 N-CA-C 105.202 -2.147 . . . . 0.0 105.202 178.31 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 10' ' ' GLU . . . . . . . . . . . . . 14.0 pt-20 -111.49 18.21 19.34 Favored 'General case' 0 C--O 1.236 0.366 0 C-N-CA 124.418 1.087 . . . . 0.0 112.769 -178.719 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 11' ' ' VAL . . . . . . . . . . . . . 9.7 m -60.99 154.61 4.45 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.303 0 C-N-CA 124.929 1.291 . . . . 0.0 110.14 179.134 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 12' ' ' ARG . . . . . . . . . . . . . 4.9 ptm180 -130.47 6.45 4.82 Favored 'General case' 0 N--CA 1.466 0.366 0 C-N-CA 123.417 0.687 . . . . 0.0 112.474 179.819 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 13' ' ' GLN . . . . . . . . . . . . . 71.7 mt-30 -122.39 91.51 3.52 Favored 'General case' 0 N--CA 1.45 -0.469 0 N-CA-C 106.598 -1.63 . . . . 0.0 106.598 179.357 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 20.1 ptmt -63.26 -25.79 68.48 Favored 'General case' 0 CA--C 1.531 0.25 0 O-C-N 122.173 -0.33 . . . . 0.0 111.069 179.369 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 3.4 t -72.62 176.45 5.47 Favored 'General case' 0 N--CA 1.451 -0.378 0 N-CA-C 108.567 -0.901 . . . . 0.0 108.567 178.518 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 12.1 t -128.46 115.82 39.29 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.663 0 N-CA-C 103.944 -2.613 . . . . 0.0 103.944 178.954 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 9.0 p -116.74 107.14 21.69 Favored 'Isoleucine or valine' 0 C--O 1.237 0.396 0 CA-C-O 121.957 0.884 . . . . 0.0 110.819 -178.898 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 36.4 mtt180 -133.64 -175.7 3.91 Favored 'General case' 0 C--O 1.239 0.525 0 N-CA-C 108.622 -0.881 . . . . 0.0 108.622 178.189 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 1.9 m -122.34 105.91 10.61 Favored 'General case' 0 N--CA 1.448 -0.555 0 N-CA-C 102.155 -3.276 . . . . 0.0 102.155 178.621 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 15.5 tp -112.27 89.74 3.15 Favored 'General case' 0 N--CA 1.442 -0.836 0 C-N-CA 125.241 1.416 . . . . 0.0 110.454 -177.975 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -63.38 157.42 23.18 Favored 'General case' 0 N--CA 1.452 -0.347 0 C-N-CA 124.614 1.166 . . . . 0.0 110.125 178.177 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 22' ' ' PHE . . . . . . . . . . . . . 88.2 m-85 -138.65 143.63 39.32 Favored 'General case' 0 C--O 1.236 0.389 0 N-CA-C 103.915 -2.624 . . . . 0.0 103.915 177.198 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 3.3 m -73.88 169.41 18.94 Favored Pre-proline 0 C--N 1.32 -0.692 0 C-N-CA 124.204 1.002 . . . . 0.0 109.535 -179.144 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 24' ' ' PRO . . . . . . . . . . . . . 33.9 Cg_endo -63.25 -43.61 17.93 Favored 'Trans proline' 0 N--CA 1.46 -0.493 0 C-N-CA 121.401 1.401 . . . . 0.0 111.277 -179.371 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 25' ' ' VAL . . . . . . . . . . . . . 24.6 t -66.68 -39.91 84.88 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.298 0 C-N-CA 124.575 1.15 . . . . 0.0 110.313 -179.92 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 83.7 mt-10 -67.13 -44.25 80.34 Favored 'General case' 0 C--N 1.339 0.115 0 N-CA-C 109.359 -0.608 . . . . 0.0 109.359 -179.854 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 27' ' ' ASP . . . . . . . . . . . . . 28.9 t70 -61.3 -44.86 96.51 Favored 'General case' 0 C--O 1.214 -0.783 0 C-N-CA 123.739 0.815 . . . . 0.0 109.131 179.305 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 28' ' ' GLU . . . . . . . . . . . . . 72.7 tt0 -57.64 -52.91 63.51 Favored 'General case' 0 N--CA 1.445 -0.698 0 C-N-CA 125.019 1.328 . . . . 0.0 108.892 178.398 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 96.2 m -60.49 -53.39 58.1 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-N 120.343 1.429 . . . . 0.0 110.36 179.316 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 50.4 mt -55.3 -49.98 68.43 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.272 0 C-N-CA 123.099 0.559 . . . . 0.0 109.761 -179.513 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 31.8 ttt85 -62.09 -43.4 98.92 Favored 'General case' 0 CA--C 1.51 -0.593 0 CA-C-O 117.425 -1.274 . . . . 0.0 110.908 -179.17 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 9.7 mptt -61.11 -48.81 79.95 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 119.85 1.205 . . . . 0.0 109.164 -179.828 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -63.61 -49.34 73.69 Favored 'General case' 0 N--CA 1.455 -0.186 0 CA-C-N 117.988 0.358 . . . . 0.0 110.183 -179.133 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 34' ' ' ALA . . . . . . . . . . . . . . . -56.3 -57.04 13.96 Favored 'General case' 0 N--CA 1.452 -0.326 0 C-N-CA 126.41 1.884 . . . . 0.0 111.069 179.866 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 59.8 tt0 -60.94 -42.65 98.61 Favored 'General case' 0 C--O 1.233 0.202 0 C-N-CA 125.181 1.392 . . . . 0.0 111.286 -178.454 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 36' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -65.52 -40.86 93.44 Favored 'General case' 0 C--N 1.333 -0.134 0 C-N-CA 123.604 0.762 . . . . 0.0 108.957 179.622 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 37' ' ' SER . . . . . . . . . . . . . 9.9 t -77.77 -4.77 48.1 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 124.151 0.981 . . . . 0.0 110.128 178.553 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 63.53 25.9 69.17 Favored Glycine 0 CA--C 1.529 0.948 0 C-N-CA 124.662 1.125 . . . . 0.0 112.912 -179.842 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 39' ' ' LEU . . . . . . . . . . . . . 40.2 mt -119.19 120.94 38.56 Favored 'General case' 0 CA--C 1.507 -0.692 0 N-CA-C 105.439 -2.06 . . . . 0.0 105.439 179.729 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 40' ' ' THR . . . . . . . . . . . . . 12.8 t -53.54 148.87 8.71 Favored 'General case' 0 C--O 1.237 0.407 0 N-CA-C 108.43 -0.952 . . . . 0.0 108.43 178.44 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 41' ' ' VAL . . . . . . . . . . . . . 22.0 m -48.23 -34.3 4.8 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.721 0 CA-C-N 114.79 -1.096 . . . . 0.0 112.142 -179.149 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 42' ' ' SER . . . . . . . . . . . . . 22.9 t -61.27 -49.96 74.96 Favored 'General case' 0 CA--C 1.544 0.744 0 CA-C-N 119.611 1.096 . . . . 0.0 110.143 178.868 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -67.51 -43.42 80.92 Favored 'General case' 0 C--O 1.225 -0.212 0 C-N-CA 123.592 0.757 . . . . 0.0 109.078 178.722 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 44' ' ' TYR . . . . . . . . . . . . . 74.5 t80 -54.58 -50.47 67.92 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 123.163 0.585 . . . . 0.0 109.722 179.529 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 45' ' ' ILE . . . . . . . . . . . . . 12.4 mm -57.28 -64.23 0.55 Allowed 'Isoleucine or valine' 0 C--N 1.341 0.208 0 C-N-CA 125.762 1.625 . . . . 0.0 110.336 179.834 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 46' ' ' ARG . . . . . . . . . . . . . 21.9 ptt180 -53.12 -46.83 68.92 Favored 'General case' 0 C--O 1.222 -0.361 0 CA-C-O 119.148 -0.453 . . . . 0.0 111.06 -178.267 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 47' ' ' ASN . . . . . . . . . . . . . 34.5 t30 -57.76 -51.57 69.04 Favored 'General case' 0 N--CA 1.453 -0.279 0 CA-C-O 118.819 -0.61 . . . . 0.0 111.288 -179.527 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -61.2 -32.77 72.53 Favored 'General case' 0 CA--C 1.53 0.206 0 C-N-CA 123.326 0.651 . . . . 0.0 111.366 -179.899 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 49' ' ' ALA . . . . . . . . . . . . . . . -77.53 -17.72 57.66 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 124.416 1.086 . . . . 0.0 113.729 -179.438 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 22.0 mt -102.84 -37.24 7.94 Favored 'General case' 0 CA--C 1.517 -0.306 0 CA-C-N 118.857 0.753 . . . . 0.0 110.987 -179.546 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 51' ' ' ASN . . . . . . . . . . . . . 7.4 m-80 . . . . . 0 C--O 1.248 1.02 0 C-N-CA 125.302 1.441 . . . . 0.0 107.953 179.704 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 65.8 p . . . . . 0 N--CA 1.467 0.397 0 N-CA-C 109.315 -0.624 . . . . 0.0 109.315 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 5.7 p-10 -69.07 -15.47 63.45 Favored 'General case' 0 N--CA 1.468 0.465 0 C-N-CA 124.794 1.238 . . . . 0.0 111.288 178.657 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 32.4 t -127.44 139.91 52.51 Favored 'General case' 0 N--CA 1.445 -0.678 0 C-N-CA 125.087 1.355 . . . . 0.0 108.239 179.926 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -170.47 161.17 7.78 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 129.657 3.183 . . . . 0.0 106.92 179.069 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 14.5 m -151.48 173.19 0.95 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.335 0 C-N-CA 124.955 1.302 . . . . 0.0 110.131 179.294 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 20.5 mtp180 -71.39 127.61 33.15 Favored 'General case' 0 C--O 1.232 0.184 0 N-CA-C 105.397 -2.075 . . . . 0.0 105.397 177.934 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -145.1 174.63 10.89 Favored 'General case' 0 C--O 1.237 0.408 0 C-N-CA 123.756 0.822 . . . . 0.0 111.104 179.703 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 10.7 mptt -62.89 137.11 58.18 Favored 'General case' 0 C--O 1.232 0.147 0 C-N-CA 125.474 1.51 . . . . 0.0 109.668 -179.356 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 11.6 t -83.9 75.0 10.15 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-O 121.609 0.718 . . . . 0.0 109.76 179.836 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 71.8 mm-40 -80.84 18.4 1.0 Allowed 'General case' 0 CA--C 1.542 0.639 0 O-C-N 121.066 -1.021 . . . . 0.0 110.758 178.757 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 11.0 p -47.66 -38.7 6.54 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.345 0 C-N-CA 126.997 2.119 . . . . 0.0 112.159 -179.706 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 7.0 ptp180 -65.95 -29.51 69.93 Favored 'General case' 0 C--O 1.233 0.201 0 N-CA-C 114.145 1.165 . . . . 0.0 114.145 -179.552 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 13.7 tt0 -134.96 87.59 2.35 Favored 'General case' 0 C--O 1.227 -0.106 0 CA-C-N 120.433 1.47 . . . . 0.0 108.849 -179.75 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 21.6 pttm -70.0 -30.76 68.17 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.0 -0.546 . . . . 0.0 111.975 179.501 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' THR . . . . . 0.507 ' CG2' HH11 ' B' ' 21' ' ' ARG . 7.2 t -76.74 155.08 33.5 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-O 122.179 0.99 . . . . 0.0 108.861 178.952 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 18.0 t -91.85 149.15 4.22 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.724 0 N-CA-C 106.069 -1.826 . . . . 0.0 106.069 178.297 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 10.4 p -139.82 90.62 0.6 Allowed 'Isoleucine or valine' 0 N--CA 1.442 -0.863 0 N-CA-C 104.701 -2.333 . . . . 0.0 104.701 177.321 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 50.6 ttt180 -116.02 170.74 8.26 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 114.519 -1.219 . . . . 0.0 108.645 -179.288 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 10.8 m -117.09 128.34 55.05 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 106.846 -1.539 . . . . 0.0 106.846 179.779 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -125.9 150.47 47.91 Favored 'General case' 0 C--O 1.235 0.31 0 C-N-CA 124.949 1.3 . . . . 0.0 109.235 -179.362 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 68.5 mtt180 -137.8 158.7 43.82 Favored 'General case' 0 N--CA 1.447 -0.587 0 C-N-CA 125.411 1.485 . . . . 0.0 108.232 178.439 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 50.0 m-85 -145.12 156.57 43.96 Favored 'General case' 0 C--O 1.237 0.415 0 N-CA-C 107.84 -1.17 . . . . 0.0 107.84 179.687 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -68.91 168.9 12.92 Favored Pre-proline 0 CA--C 1.543 0.704 0 N-CA-C 107.421 -1.326 . . . . 0.0 107.421 178.7 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 25.3 Cg_endo -61.93 -45.06 17.69 Favored 'Trans proline' 0 N--CA 1.456 -0.702 0 CA-C-N 120.701 1.286 . . . . 0.0 111.264 -178.761 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 72.1 t -65.82 -42.6 92.57 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.29 0 C-N-CA 123.077 0.551 . . . . 0.0 109.908 179.536 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 7.2 mm-40 -60.35 -45.38 93.68 Favored 'General case' 0 CA--C 1.531 0.223 0 C-N-CA 123.307 0.643 . . . . 0.0 109.358 -179.893 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 26.9 t70 -66.59 -44.03 83.29 Favored 'General case' 0 C--O 1.221 -0.416 0 CA-C-O 118.984 -0.532 . . . . 0.0 110.223 179.562 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 31.7 tt0 -58.08 -43.55 87.07 Favored 'General case' 0 CA--C 1.531 0.213 0 C-N-CA 124.758 1.223 . . . . 0.0 109.055 178.976 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 37.4 m -61.22 -50.63 72.31 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 124.283 1.033 . . . . 0.0 108.634 179.273 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 64.7 mt -61.49 -41.34 89.68 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.327 0 N-CA-C 109.262 -0.644 . . . . 0.0 109.262 179.677 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 23.3 ttp85 -60.39 -46.39 90.14 Favored 'General case' 0 N--CA 1.461 0.099 0 C-N-CA 124.003 0.921 . . . . 0.0 109.575 -179.627 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 1.9 mptm? -59.98 -59.04 6.05 Favored 'General case' 0 N--CA 1.45 -0.453 0 C-N-CA 124.993 1.317 . . . . 0.0 110.956 179.537 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 17.5 tptt -60.84 -40.86 94.43 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-O 118.576 -0.726 . . . . 0.0 111.588 -177.479 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -58.45 -51.65 68.94 Favored 'General case' 0 N--CA 1.452 -0.348 0 N-CA-C 108.596 -0.89 . . . . 0.0 108.596 178.813 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 21.8 tt0 -62.17 -41.99 98.84 Favored 'General case' 0 CA--C 1.529 0.157 0 C-N-CA 123.238 0.615 . . . . 0.0 112.093 -179.565 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 38.7 t70 -66.56 -22.88 66.15 Favored 'General case' 0 C--O 1.232 0.167 0 C-N-CA 126.562 1.945 . . . . 0.0 111.281 -179.856 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 10.4 t -97.15 -8.28 30.47 Favored 'General case' 0 N--CA 1.449 -0.523 0 C-N-CA 127.076 2.151 . . . . 0.0 110.994 179.688 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 64.11 31.66 81.59 Favored Glycine 0 CA--C 1.532 1.134 0 O-C-N 120.723 -1.236 . . . . 0.0 111.418 -179.327 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 55.7 mt -127.8 132.54 49.47 Favored 'General case' 0 N--CA 1.448 -0.536 0 N-CA-C 105.2 -2.148 . . . . 0.0 105.2 -179.981 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 8.4 t -61.75 152.76 30.35 Favored 'General case' 0 CA--C 1.538 0.5 0 N-CA-C 107.692 -1.225 . . . . 0.0 107.692 178.679 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 24.1 t -48.33 -41.32 10.8 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.289 0 C-N-CA 124.549 1.14 . . . . 0.0 111.755 -179.974 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 13.5 p -63.65 -38.25 90.39 Favored 'General case' 0 CA--C 1.532 0.255 0 O-C-N 121.024 -1.048 . . . . 0.0 112.08 179.841 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -69.66 -46.86 65.17 Favored 'General case' 0 C--O 1.222 -0.354 0 N-CA-C 107.607 -1.257 . . . . 0.0 107.607 178.334 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 69.6 t80 -52.87 -46.31 67.85 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 123.973 0.909 . . . . 0.0 110.112 179.152 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 14.8 mm -56.98 -63.57 0.63 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.315 0 C-N-CA 124.044 0.938 . . . . 0.0 110.526 179.429 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 12.4 ptt180 -55.47 -45.16 76.94 Favored 'General case' 0 C--O 1.222 -0.365 0 C-N-CA 123.497 0.719 . . . . 0.0 110.989 -178.55 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 32.2 t30 -58.69 -55.79 30.6 Favored 'General case' 0 N--CA 1.449 -0.521 0 C-N-CA 124.601 1.16 . . . . 0.0 109.065 -179.189 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -61.77 -25.9 67.75 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 123.065 0.546 . . . . 0.0 112.442 179.637 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -79.07 -19.38 51.44 Favored 'General case' 0 CA--C 1.536 0.44 0 N-CA-C 113.341 0.867 . . . . 0.0 113.341 179.523 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 7.9 mt -115.3 -29.03 6.7 Favored 'General case' 0 N--CA 1.466 0.328 0 N-CA-C 114.133 1.16 . . . . 0.0 114.133 -177.966 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 2.0 m-80 . . . . . 0 C--O 1.249 1.048 0 C-N-CA 125.512 1.525 . . . . 0.0 110.3 -178.183 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' B' B ' 1' ' ' SER . . . . . . . . . . . . . 77.3 p . . . . . 0 N--CA 1.466 0.331 0 CA-C-O 118.802 -0.618 . . . . 0.0 110.671 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' B' B ' 2' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -55.14 -64.23 0.9 Allowed 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 126.667 1.987 . . . . 0.0 109.764 178.328 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 3' ' ' SER . . . . . . . . . . . . . 29.6 t -69.85 103.7 2.27 Favored 'General case' 0 N--CA 1.443 -0.784 0 C-N-CA 127.235 2.214 . . . . 0.0 106.783 179.186 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 4' ' ' ALA . . . . . . . . . . . . . . . -130.25 82.42 2.06 Favored 'General case' 0 CA--C 1.531 0.221 0 C-N-CA 125.243 1.417 . . . . 0.0 111.275 -179.311 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 34.8 m -89.72 173.76 0.85 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.414 0 N-CA-C 108.839 -0.8 . . . . 0.0 108.839 178.53 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 6' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -72.95 141.04 47.8 Favored 'General case' 0 C--O 1.234 0.275 0 O-C-N 121.57 -0.706 . . . . 0.0 109.434 179.033 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -124.79 153.3 42.69 Favored 'General case' 0 C--O 1.237 0.426 0 N-CA-C 106.13 -1.804 . . . . 0.0 106.13 177.403 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 12.1 mptt -72.6 177.12 4.91 Favored 'General case' 0 CA--C 1.538 0.506 0 N-CA-C 107.846 -1.168 . . . . 0.0 107.846 -179.494 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 20.5 t -93.45 97.49 10.58 Favored 'General case' 0 C--N 1.331 -0.229 0 O-C-N 120.409 -1.432 . . . . 0.0 108.513 -179.947 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 10' ' ' GLU . . . . . . . . . . . . . 3.0 pm0 -123.56 7.06 8.89 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 125.069 1.348 . . . . 0.0 111.841 179.366 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 11' ' ' VAL . . . . . . . . . . . . . 13.8 p -53.15 -30.76 17.05 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.379 0 C-N-CA 124.782 1.233 . . . . 0.0 111.631 179.627 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 12' ' ' ARG . . . . . . . . . . . . . 9.5 ptm180 -56.8 -20.26 21.56 Favored 'General case' 0 C--O 1.233 0.21 0 C-N-CA 124.065 0.946 . . . . 0.0 112.637 179.299 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 13' ' ' GLN . . . . . . . . . . . . . 36.9 tt0 -151.36 80.01 1.29 Allowed 'General case' 0 N--CA 1.447 -0.581 0 N-CA-C 106.69 -1.596 . . . . 0.0 106.69 179.89 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 24.3 pttm -64.64 -30.99 72.02 Favored 'General case' 0 N--CA 1.462 0.174 0 C-N-CA 123.946 0.898 . . . . 0.0 112.58 179.538 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 7.9 t -65.09 170.47 4.45 Favored 'General case' 0 N--CA 1.449 -0.483 0 N-CA-C 106.201 -1.777 . . . . 0.0 106.201 178.184 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 9.3 p -109.98 155.99 11.03 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.813 0 N-CA-C 104.619 -2.363 . . . . 0.0 104.619 177.391 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 14.2 p -138.79 122.18 19.3 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.734 0 N-CA-C 106.305 -1.739 . . . . 0.0 106.305 177.964 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 23.8 ttt180 -140.65 159.09 42.97 Favored 'General case' 0 CA--C 1.516 -0.334 0 CA-C-O 122.826 1.298 . . . . 0.0 111.44 179.565 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 1.3 m -108.06 102.47 11.63 Favored 'General case' 0 N--CA 1.445 -0.71 0 N-CA-C 101.294 -3.595 . . . . 0.0 101.294 179.693 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -108.52 120.28 41.98 Favored 'General case' 0 CA--C 1.515 -0.372 0 C-N-CA 124.437 1.095 . . . . 0.0 108.375 -178.504 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 21' ' ' ARG . . . . . 0.507 HH11 ' CG2' ' A' ' 15' ' ' THR . 24.2 mtt180 -95.71 153.65 17.62 Favored 'General case' 0 N--CA 1.449 -0.493 0 N-CA-C 109.109 -0.7 . . . . 0.0 109.109 179.188 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 22' ' ' PHE . . . . . . . . . . . . . 92.9 m-85 -134.88 144.27 47.44 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 106.728 -1.582 . . . . 0.0 106.728 -179.814 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -74.78 171.16 12.28 Favored Pre-proline 0 CA--C 1.544 0.741 0 N-CA-C 108.075 -1.083 . . . . 0.0 108.075 179.948 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 24' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -66.94 -31.32 38.12 Favored 'Trans proline' 0 N--CA 1.459 -0.547 0 C-N-CA 121.472 1.448 . . . . 0.0 113.562 -178.332 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 25' ' ' VAL . . . . . . . . . . . . . 89.8 t -75.37 -40.8 42.81 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.307 0 N-CA-C 109.031 -0.729 . . . . 0.0 109.031 -179.832 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -62.86 -48.18 80.13 Favored 'General case' 0 C--O 1.217 -0.631 0 N-CA-C 108.164 -1.051 . . . . 0.0 108.164 179.889 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 27' ' ' ASP . . . . . . . . . . . . . 20.9 t0 -56.03 -48.51 75.84 Favored 'General case' 0 CA--C 1.515 -0.385 0 C-N-CA 124.899 1.28 . . . . 0.0 111.169 -179.514 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 28' ' ' GLU . . . . . . . . . . . . . 36.1 tt0 -60.51 -47.15 87.42 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 124.58 1.152 . . . . 0.0 108.833 179.097 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 31.7 m -60.89 -55.15 36.37 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 124.167 0.987 . . . . 0.0 110.428 179.484 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 96.7 mt -62.21 -30.83 49.73 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.48 0 C-N-CA 126.132 1.773 . . . . 0.0 110.641 -178.654 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 9.6 ttt85 -67.58 -43.82 79.64 Favored 'General case' 0 C--N 1.327 -0.395 0 O-C-N 120.515 -1.366 . . . . 0.0 110.104 179.437 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 1.2 mptm? -78.47 -44.46 24.53 Favored 'General case' 0 C--O 1.225 -0.214 0 CA-C-O 117.552 -1.213 . . . . 0.0 113.918 -178.07 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 34.9 tptt -62.64 -39.68 94.61 Favored 'General case' 0 N--CA 1.462 0.166 0 CA-C-N 119.966 1.257 . . . . 0.0 110.615 -178.109 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 34' ' ' ALA . . . . . . . . . . . . . . . -58.73 -55.74 31.17 Favored 'General case' 0 N--CA 1.448 -0.539 0 C-N-CA 124.839 1.256 . . . . 0.0 109.019 179.072 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 16.8 tt0 -65.46 -34.89 79.35 Favored 'General case' 0 N--CA 1.453 -0.316 0 CA-C-N 115.37 -0.832 . . . . 0.0 113.027 -178.321 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 36' ' ' ASP . . . . . . . . . . . . . 18.3 t70 -64.86 -40.85 95.79 Favored 'General case' 0 C--O 1.235 0.334 0 N-CA-C 107.929 -1.137 . . . . 0.0 107.929 178.361 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 37' ' ' SER . . . . . . . . . . . . . 6.9 t -77.75 -7.17 56.17 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 124.887 1.275 . . . . 0.0 110.671 178.821 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 72.7 2.54 56.7 Favored Glycine 0 CA--C 1.534 1.265 0 C-N-CA 125.032 1.301 . . . . 0.0 112.257 -179.068 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 39' ' ' LEU . . . . . . . . . . . . . 11.2 mt -99.6 106.31 18.27 Favored 'General case' 0 N--CA 1.447 -0.6 0 C-N-CA 125.952 1.701 . . . . 0.0 107.294 -179.52 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 40' ' ' THR . . . . . . . . . . . . . 8.8 t -45.27 150.83 0.4 Allowed 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 124.947 1.299 . . . . 0.0 109.67 179.016 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 41' ' ' VAL . . . . . . . . . . . . . 65.4 t -43.46 -44.64 1.61 Allowed 'Isoleucine or valine' 0 N--CA 1.461 0.096 0 C-N-CA 125.85 1.66 . . . . 0.0 112.473 -177.705 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 42' ' ' SER . . . . . . . . . . . . . 1.4 p -61.41 -46.75 88.84 Favored 'General case' 0 CA--C 1.538 0.489 0 CA-C-N 119.518 1.053 . . . . 0.0 111.615 179.896 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -66.52 -39.03 88.41 Favored 'General case' 0 C--O 1.225 -0.2 0 C-N-CA 123.251 0.621 . . . . 0.0 109.566 178.557 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 44' ' ' TYR . . . . . . . . . . . . . 61.7 t80 -58.82 -52.85 63.96 Favored 'General case' 0 C--O 1.221 -0.413 0 N-CA-C 108.495 -0.928 . . . . 0.0 108.495 179.134 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 45' ' ' ILE . . . . . . . . . . . . . 21.2 mm -53.45 -61.63 0.84 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.196 0 C-N-CA 124.173 0.989 . . . . 0.0 109.577 179.819 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 46' ' ' ARG . . . . . . . . . . . . . 18.4 ptt180 -52.0 -47.51 64.88 Favored 'General case' 0 CA--C 1.53 0.194 0 N-CA-C 112.704 0.631 . . . . 0.0 112.704 -179.012 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 47' ' ' ASN . . . . . . . . . . . . . 32.6 t30 -66.05 -52.44 48.96 Favored 'General case' 0 C--N 1.329 -0.322 0 C-N-CA 125.37 1.468 . . . . 0.0 112.987 -179.352 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -61.84 -33.26 73.84 Favored 'General case' 0 C--O 1.223 -0.333 0 C-N-CA 125.293 1.437 . . . . 0.0 110.976 -179.594 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 49' ' ' ALA . . . . . . . . . . . . . . . -66.71 -55.57 14.51 Favored 'General case' 0 N--CA 1.444 -0.762 0 C-N-CA 122.41 0.284 . . . . 0.0 111.02 -179.77 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 14.8 mt -69.62 -40.19 76.74 Favored 'General case' 0 CA--C 1.516 -0.341 0 N-CA-C 115.562 1.69 . . . . 0.0 115.562 -177.327 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 51' ' ' ASN . . . . . . . . . . . . . 57.0 m-80 . . . . . 0 C--O 1.251 1.153 0 CA-C-O 118.321 -0.847 . . . . 0.0 111.165 -176.774 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 44.5 m . . . . . 0 N--CA 1.47 0.533 0 N-CA-C 107.496 -1.298 . . . . 0.0 107.496 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 44.6 m-20 -71.76 174.49 6.77 Favored 'General case' 0 C--O 1.237 0.433 0 C-N-CA 123.393 0.677 . . . . 0.0 111.803 -178.092 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 19.3 p -136.02 171.49 14.4 Favored 'General case' 0 C--O 1.234 0.265 0 C-N-CA 125.18 1.392 . . . . 0.0 110.462 -179.831 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -71.56 102.43 2.72 Favored 'General case' 0 N--CA 1.453 -0.311 0 N-CA-C 105.521 -2.029 . . . . 0.0 105.521 178.358 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 12.5 p -123.16 -36.61 1.2 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 C-N-CA 124.78 1.232 . . . . 0.0 110.047 -178.822 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 29.5 mtp-105 -86.4 160.86 18.93 Favored 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 125.598 1.559 . . . . 0.0 106.817 178.838 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 28.7 mtpt -129.52 -92.84 0.44 Allowed 'General case' 0 N--CA 1.465 0.279 0 O-C-N 121.144 -0.973 . . . . 0.0 108.987 -179.866 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 18.9 pttp -135.69 105.95 6.37 Favored 'General case' 0 C--O 1.235 0.293 0 C-N-CA 124.676 1.19 . . . . 0.0 110.426 -179.456 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 65.8 m -144.75 131.39 19.97 Favored 'General case' 0 C--N 1.332 -0.163 0 C-N-CA 124.209 1.003 . . . . 0.0 108.328 178.847 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 -94.34 81.47 4.0 Favored 'General case' 0 C--N 1.331 -0.221 0 N-CA-C 108.8 -0.815 . . . . 0.0 108.8 -179.274 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 94.7 t -138.11 129.75 38.43 Favored 'Isoleucine or valine' 0 C--O 1.235 0.316 0 N-CA-C 106.261 -1.755 . . . . 0.0 106.261 179.379 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 24.9 ptt180 -130.76 86.37 2.37 Favored 'General case' 0 C--N 1.333 -0.15 0 C-N-CA 124.679 1.192 . . . . 0.0 108.514 -179.866 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 13.8 pt20 -127.05 104.33 7.93 Favored 'General case' 0 CA--C 1.519 -0.226 0 C-N-CA 125.065 1.346 . . . . 0.0 109.941 -179.517 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 15.0 ptmt -98.25 27.41 4.67 Favored 'General case' 0 C--N 1.327 -0.386 0 O-C-N 121.65 -0.656 . . . . 0.0 109.955 178.45 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 11.8 t -160.89 159.46 29.74 Favored 'General case' 0 N--CA 1.437 -1.1 0 N-CA-C 107.844 -1.169 . . . . 0.0 107.844 179.398 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 95.9 t -97.28 154.64 3.69 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.879 0 N-CA-C 104.457 -2.423 . . . . 0.0 104.457 177.835 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 8.3 p -144.09 101.85 0.7 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.532 0 N-CA-C 105.598 -2.001 . . . . 0.0 105.598 178.68 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 10.6 ttm180 -144.09 172.7 12.53 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 107.843 -1.169 . . . . 0.0 107.843 179.392 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -121.59 136.87 54.93 Favored 'General case' 0 C--N 1.321 -0.637 0 C-N-CA 127.217 2.207 . . . . 0.0 107.597 -179.567 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 74.0 mt -120.84 170.8 9.13 Favored 'General case' 0 C--O 1.236 0.39 0 N-CA-C 107.464 -1.309 . . . . 0.0 107.464 178.547 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 23.4 mmt-85 -128.77 151.16 49.88 Favored 'General case' 0 C--N 1.327 -0.412 0 C-N-CA 124.978 1.311 . . . . 0.0 107.967 179.639 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 98.5 m-85 -147.87 140.91 24.95 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 106.429 -1.693 . . . . 0.0 106.429 179.588 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 1.5 m -68.96 172.14 5.37 Favored Pre-proline 0 CA--C 1.545 0.755 0 C-N-CA 124.26 1.024 . . . . 0.0 108.664 179.381 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 59.4 Cg_endo -67.72 -38.28 14.21 Favored 'Trans proline' 0 N--CA 1.458 -0.609 0 CA-C-N 121.271 1.49 . . . . 0.0 111.351 -179.067 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 21.3 t -72.46 -36.38 54.34 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.488 0 C-N-CA 123.105 0.562 . . . . 0.0 109.796 179.632 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -67.85 -42.66 81.03 Favored 'General case' 0 C--O 1.225 -0.224 0 N-CA-C 108.724 -0.843 . . . . 0.0 108.724 179.377 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 26.5 t70 -65.4 -46.02 81.68 Favored 'General case' 0 C--O 1.224 -0.286 0 N-CA-C 108.915 -0.772 . . . . 0.0 108.915 178.763 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 63.9 tt0 -54.74 -48.57 72.4 Favored 'General case' 0 N--CA 1.452 -0.367 0 C-N-CA 125.112 1.365 . . . . 0.0 108.052 178.23 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 46.1 m -67.51 -51.31 52.6 Favored 'General case' 0 C--O 1.222 -0.388 0 C-N-CA 124.149 0.98 . . . . 0.0 111.3 -179.441 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 59.6 mt -60.25 -31.96 49.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 O-C-N 120.52 -1.363 . . . . 0.0 110.109 -179.436 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 31.9 ttt180 -76.24 -45.14 34.31 Favored 'General case' 0 CA--C 1.511 -0.545 0 N-CA-C 109.318 -0.623 . . . . 0.0 109.318 -179.151 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . 0.391 0.0 OUTLIER -66.04 -30.64 71.21 Favored 'General case' 0 N--CA 1.45 -0.447 0 O-C-N 123.277 0.361 . . . . 0.0 110.259 -179.856 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 7.4 mmmm -77.48 -48.91 15.92 Favored 'General case' 0 C--O 1.222 -0.362 0 N-CA-C 107.346 -1.353 . . . . 0.0 107.346 178.178 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -54.4 -57.14 12.45 Favored 'General case' 0 C--N 1.339 0.112 0 C-N-CA 124.083 0.953 . . . . 0.0 110.278 -179.803 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 7.5 tp10 -62.96 -41.26 99.47 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-O 118.881 -0.581 . . . . 0.0 111.845 -179.059 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 37.0 t70 -66.36 -26.84 67.46 Favored 'General case' 0 N--CA 1.47 0.571 0 CA-C-N 119.435 1.016 . . . . 0.0 110.724 179.771 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 1.7 t -89.81 -2.28 58.18 Favored 'General case' 0 N--CA 1.447 -0.625 0 C-N-CA 124.533 1.133 . . . . 0.0 110.119 178.861 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 65.23 33.97 88.29 Favored Glycine 0 CA--C 1.526 0.77 0 CA-C-O 118.835 -0.98 . . . . 0.0 112.569 179.627 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 81.0 mt -128.29 152.58 47.96 Favored 'General case' 0 C--O 1.233 0.23 0 C-N-CA 125.502 1.521 . . . . 0.0 108.589 179.924 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -76.71 148.48 36.75 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 104.24 -2.504 . . . . 0.0 104.24 177.183 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 20.1 t -50.35 -39.78 17.35 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.539 0 C-N-CA 124.683 1.193 . . . . 0.0 109.477 177.844 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 66.2 p -58.75 -48.14 82.24 Favored 'General case' 0 CA--C 1.539 0.555 0 O-C-N 121.105 -0.997 . . . . 0.0 111.777 179.47 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -67.6 -46.44 72.58 Favored 'General case' 0 C--O 1.221 -0.403 0 C-N-CA 125.09 1.356 . . . . 0.0 108.581 179.053 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 55.0 t80 -52.66 -53.66 44.09 Favored 'General case' 0 N--CA 1.451 -0.379 0 C-N-CA 124.703 1.201 . . . . 0.0 109.487 179.959 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 18.4 mm -51.94 -62.11 0.63 Allowed 'Isoleucine or valine' 0 C--N 1.341 0.218 0 C-N-CA 124.575 1.15 . . . . 0.0 111.258 -179.784 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 12.7 ptm180 -60.92 -46.28 91.31 Favored 'General case' 0 C--O 1.222 -0.374 0 CA-C-O 118.687 -0.673 . . . . 0.0 111.687 -178.682 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 10.7 t30 -51.96 -55.22 21.7 Favored 'General case' 0 C--N 1.332 -0.184 0 C-N-CA 124.405 1.082 . . . . 0.0 110.089 -179.443 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -66.18 -29.83 70.18 Favored 'General case' 0 N--CA 1.453 -0.298 0 C-N-CA 124.99 1.316 . . . . 0.0 113.149 179.924 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -81.38 -19.8 41.9 Favored 'General case' 0 N--CA 1.462 0.151 0 N-CA-C 113.362 0.875 . . . . 0.0 113.362 -179.303 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 23.4 mt -106.19 -36.98 6.73 Favored 'General case' 0 CA--C 1.516 -0.332 0 N-CA-C 114.015 1.117 . . . . 0.0 114.015 -178.533 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 12.7 m-80 . . . . . 0 C--O 1.248 1.015 0 CA-C-O 117.805 -1.093 . . . . 0.0 110.972 -176.975 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' B' B ' 1' ' ' SER . . . . . . . . . . . . . 38.2 m . . . . . 0 C--O 1.237 0.418 0 CA-C-O 120.409 0.147 . . . . 0.0 110.819 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' B' B ' 2' ' ' ASP . . . . . . . . . . . . . 3.5 p-10 -92.96 166.03 12.58 Favored 'General case' 0 N--CA 1.464 0.261 0 C-N-CA 124.259 1.024 . . . . 0.0 108.867 178.791 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 3' ' ' SER . . . . . . . . . . . . . 51.5 p -135.34 163.82 29.14 Favored 'General case' 0 C--O 1.241 0.609 0 C-N-CA 124.683 1.193 . . . . 0.0 111.394 -178.909 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 4' ' ' ALA . . . . . . . . . . . . . . . -78.54 75.96 5.05 Favored 'General case' 0 N--CA 1.451 -0.389 0 C-N-CA 124.907 1.283 . . . . 0.0 108.58 178.995 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 10.4 p -79.63 -27.19 12.62 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.543 0 C-N-CA 123.909 0.884 . . . . 0.0 108.931 178.952 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 6' ' ' ARG . . . . . . . . . . . . . 87.0 mtt180 -70.64 163.39 27.15 Favored 'General case' 0 CA--C 1.534 0.338 0 N-CA-C 108.528 -0.915 . . . . 0.0 108.528 178.274 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 54.0 mtpt -133.4 -77.37 0.48 Allowed 'General case' 0 N--CA 1.467 0.384 0 O-C-N 121.263 -0.898 . . . . 0.0 109.955 -179.824 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 13.0 pttp -154.51 88.07 1.2 Allowed 'General case' 0 N--CA 1.456 -0.161 0 C-N-CA 123.806 0.842 . . . . 0.0 109.128 -179.486 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 33.3 m -136.08 136.49 40.21 Favored 'General case' 0 C--O 1.235 0.327 0 N-CA-C 107.773 -1.195 . . . . 0.0 107.773 179.517 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 10' ' ' GLU . . . . . . . . . . . . . 3.6 tt0 -99.62 0.73 42.68 Favored 'General case' 0 CA--C 1.532 0.287 0 N-CA-C 115.543 1.683 . . . . 0.0 115.543 -177.819 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 11' ' ' VAL . . . . . . . . . . . . . 89.4 t -74.34 138.72 20.55 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 N-CA-C 107.725 -1.213 . . . . 0.0 107.725 179.631 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 12' ' ' ARG . . . . . . . . . . . . . 80.5 mtt180 -140.0 130.68 25.78 Favored 'General case' 0 C--O 1.236 0.389 0 CA-C-N 119.29 0.95 . . . . 0.0 110.823 -179.536 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 13' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -148.21 96.39 2.62 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 124.171 0.988 . . . . 0.0 109.878 178.623 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 12.7 ptmt -80.25 23.96 0.46 Allowed 'General case' 0 N--CA 1.466 0.363 0 O-C-N 120.974 -1.079 . . . . 0.0 110.713 179.158 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 14.3 t -167.37 164.13 15.16 Favored 'General case' 0 N--CA 1.44 -0.955 0 C-N-CA 126.213 1.805 . . . . 0.0 106.634 -179.637 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 5.4 t -109.8 156.97 10.47 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.574 0 N-CA-C 106.515 -1.661 . . . . 0.0 106.515 177.909 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 11.5 p -137.69 113.67 11.06 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.681 0 N-CA-C 105.182 -2.155 . . . . 0.0 105.182 176.939 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 34.5 ttm-85 -145.19 149.11 34.37 Favored 'General case' 0 CA--C 1.514 -0.422 0 CA-C-O 121.059 0.457 . . . . 0.0 109.8 178.936 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -93.85 132.77 37.93 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 107.402 -1.333 . . . . 0.0 107.402 -179.482 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 69.9 mt -129.49 151.96 49.54 Favored 'General case' 0 C--O 1.239 0.542 0 N-CA-C 107.532 -1.284 . . . . 0.0 107.532 178.747 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 22.0 mmt85 -112.6 151.19 30.37 Favored 'General case' 0 C--N 1.323 -0.571 0 C-N-CA 127.977 2.511 . . . . 0.0 108.234 -179.798 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 22' ' ' PHE . . . . . . . . . . . . . 89.7 m-85 -148.73 139.43 22.78 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 104.829 -2.285 . . . . 0.0 104.829 178.769 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 4.7 m -70.57 168.54 18.97 Favored Pre-proline 0 CA--C 1.551 1.012 0 N-CA-C 108.279 -1.008 . . . . 0.0 108.279 179.408 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 24' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -66.14 -40.88 14.33 Favored 'Trans proline' 0 N--CA 1.46 -0.456 0 C-N-CA 122.475 2.117 . . . . 0.0 114.178 -177.363 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 25' ' ' VAL . . . . . . . . . . . . . 77.1 t -66.81 -45.62 87.31 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.305 0 C-N-CA 123.94 0.896 . . . . 0.0 109.51 -179.709 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -68.08 -38.85 82.84 Favored 'General case' 0 N--CA 1.453 -0.297 0 C-N-CA 124.68 1.192 . . . . 0.0 110.983 -178.495 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 27' ' ' ASP . . . . . . . . . . . . . 10.1 t70 -64.59 -44.1 91.7 Favored 'General case' 0 N--CA 1.454 -0.264 0 C-N-CA 123.102 0.561 . . . . 0.0 109.998 178.473 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 28' ' ' GLU . . . . . . . . . . . . . 26.5 tt0 -62.16 -45.75 92.02 Favored 'General case' 0 N--CA 1.449 -0.514 0 N-CA-C 108.105 -1.072 . . . . 0.0 108.105 179.556 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 31.0 m -56.06 -52.91 62.56 Favored 'General case' 0 C--N 1.341 0.199 0 N-CA-C 108.512 -0.921 . . . . 0.0 108.512 178.699 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 84.4 mt -58.0 -41.17 79.66 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.3 0 C-N-CA 122.66 0.384 . . . . 0.0 110.099 -179.717 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 37.4 ttt-85 -61.42 -47.43 85.81 Favored 'General case' 0 C--O 1.23 0.067 0 O-C-N 121.45 -0.781 . . . . 0.0 110.62 -179.647 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 2.6 mptm? -65.48 -46.83 78.2 Favored 'General case' 0 CA--C 1.523 -0.083 0 C-N-CA 123.008 0.523 . . . . 0.0 110.473 -179.593 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 9.1 mmmm -59.46 -48.31 82.13 Favored 'General case' 0 CA--C 1.527 0.065 0 N-CA-C 109.272 -0.64 . . . . 0.0 109.272 -179.655 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 34' ' ' ALA . . . . . . . . . . . . . . . -59.43 -49.77 76.52 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 124.768 1.227 . . . . 0.0 112.156 -179.821 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 5.4 tp10 -56.0 -49.69 72.94 Favored 'General case' 0 C--O 1.233 0.186 0 C-N-CA 124.414 1.086 . . . . 0.0 110.696 -179.495 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 36' ' ' ASP . . . . . . . . . . . . . 6.8 t70 -67.89 -44.05 77.88 Favored 'General case' 0 N--CA 1.454 -0.262 0 C-N-CA 124.107 0.963 . . . . 0.0 111.875 -178.927 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 37' ' ' SER . . . . . . . . . . . . . 30.4 t -66.24 -18.77 65.56 Favored 'General case' 0 N--CA 1.448 -0.556 0 C-N-CA 124.403 1.081 . . . . 0.0 110.943 -179.453 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 73.47 20.35 79.84 Favored Glycine 0 CA--C 1.528 0.893 0 N-CA-C 110.632 -0.987 . . . . 0.0 110.632 -179.189 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 39' ' ' LEU . . . . . . . . . . . . . 81.4 mt -120.45 107.81 13.34 Favored 'General case' 0 N--CA 1.447 -0.576 0 N-CA-C 103.121 -2.918 . . . . 0.0 103.121 179.56 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 40' ' ' THR . . . . . . . . . . . . . 13.8 t -50.76 156.3 0.98 Allowed 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 123.342 0.657 . . . . 0.0 109.502 -179.776 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 41' ' ' VAL . . . . . . . . . . . . . 80.8 t -44.99 -43.97 2.72 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.418 0 C-N-CA 125.019 1.328 . . . . 0.0 112.804 -177.74 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 42' ' ' SER . . . . . . . . . . . . . 9.8 p -65.48 -42.77 91.85 Favored 'General case' 0 CA--C 1.542 0.642 0 CA-C-N 119.256 0.935 . . . . 0.0 112.276 179.474 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -66.31 -45.39 80.53 Favored 'General case' 0 C--O 1.226 -0.183 0 C-N-CA 125.545 1.538 . . . . 0.0 108.921 178.941 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 44' ' ' TYR . . . . . . . . . . . . . 72.3 t80 -56.25 -51.31 68.6 Favored 'General case' 0 N--CA 1.443 -0.781 0 C-N-CA 125.685 1.594 . . . . 0.0 109.256 179.627 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 45' ' ' ILE . . . . . . . . . . . . . 9.0 mm -56.12 -58.94 3.41 Favored 'Isoleucine or valine' 0 C--N 1.34 0.162 0 C-N-CA 123.427 0.691 . . . . 0.0 110.952 179.561 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 46' ' ' ARG . . . . . . . . . . . . . 13.3 ptm180 -57.52 -48.97 77.84 Favored 'General case' 0 C--O 1.221 -0.426 0 CA-C-O 118.213 -0.898 . . . . 0.0 111.113 -178.832 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 47' ' ' ASN . . . . . . . . . . . . . 20.1 t30 -55.4 -55.94 25.89 Favored 'General case' 0 N--CA 1.452 -0.349 0 CA-C-N 118.935 0.789 . . . . 0.0 110.837 -179.493 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -59.9 -26.8 66.2 Favored 'General case' 0 CA--C 1.531 0.245 0 C-N-CA 123.529 0.732 . . . . 0.0 112.816 -179.486 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 49' ' ' ALA . . . . . . . . . . . . . . . -84.29 -12.48 54.59 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 124.176 0.991 . . . . 0.0 113.073 179.746 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 14.2 mt -109.99 -30.06 7.96 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 118.856 0.753 . . . . 0.0 111.481 179.749 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 51' ' ' ASN . . . . . . . . . . . . . 11.8 m-80 . . . . . 0 C--O 1.249 1.048 0 C-N-CA 126.057 1.743 . . . . 0.0 109.805 -178.815 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 8.4 t . . . . . 0 N--CA 1.434 -1.254 0 N-CA-C 108.59 -0.893 . . . . 0.0 108.59 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 2.5 t -103.92 134.34 45.44 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.801 0 N-CA-C 104.763 -2.31 . . . . 0.0 104.763 178.344 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 8.8 p -127.32 111.63 25.87 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 N-CA-C 106.295 -1.743 . . . . 0.0 106.295 179.102 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 61.6 ttm-85 -141.68 157.7 44.74 Favored 'General case' 0 CA--C 1.52 -0.206 0 CA-C-N 115.447 -0.797 . . . . 0.0 108.972 -179.807 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 45.0 m -95.7 110.03 22.23 Favored 'General case' 0 N--CA 1.448 -0.544 0 N-CA-C 104.62 -2.363 . . . . 0.0 104.62 178.674 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 12.6 tp -104.24 145.9 29.56 Favored 'General case' 0 C--O 1.237 0.428 0 N-CA-C 106.839 -1.541 . . . . 0.0 106.839 179.841 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 33.1 mtt180 -127.74 161.3 29.28 Favored 'General case' 0 N--CA 1.453 -0.298 0 C-N-CA 123.529 0.732 . . . . 0.0 110.306 -179.538 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 95.1 m-85 -149.49 159.03 44.65 Favored 'General case' 0 N--CA 1.465 0.298 0 C-N-CA 124.311 1.045 . . . . 0.0 108.818 -179.117 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -84.91 169.87 15.15 Favored Pre-proline 0 CA--C 1.542 0.658 0 N-CA-C 108.477 -0.935 . . . . 0.0 108.477 178.578 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -61.49 -32.64 88.5 Favored 'Trans proline' 0 C--N 1.349 0.602 0 C-N-CA 122.04 1.827 . . . . 0.0 111.811 -178.834 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 93.4 t -66.23 -58.38 6.86 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.419 0 C-N-CA 125.885 1.674 . . . . 0.0 108.511 179.526 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -56.66 -40.15 74.99 Favored 'General case' 0 CA--C 1.521 -0.148 0 CA-C-N 118.146 0.43 . . . . 0.0 111.389 -179.722 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 32.8 t70 -65.49 -42.68 91.89 Favored 'General case' 0 CA--C 1.512 -0.483 0 C-N-CA 123.989 0.916 . . . . 0.0 110.994 179.647 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 34.9 tt0 -60.28 -52.64 64.43 Favored 'General case' 0 N--CA 1.448 -0.56 0 N-CA-C 107.738 -1.208 . . . . 0.0 107.738 179.328 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 57.0 m -56.41 -56.46 20.92 Favored 'General case' 0 N--CA 1.451 -0.385 0 C-N-CA 123.046 0.538 . . . . 0.0 110.161 -179.194 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 27.8 mt -58.82 -43.38 88.02 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.536 0 N-CA-C 112.412 0.523 . . . . 0.0 112.412 -178.576 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 31.6 ttt180 -59.14 -47.0 86.9 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 118.616 0.644 . . . . 0.0 109.814 179.63 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 2.3 mptm? -66.72 -40.89 88.57 Favored 'General case' 0 CA--C 1.529 0.153 0 CA-C-O 119.456 -0.307 . . . . 0.0 110.248 -179.726 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 8.4 tptt -64.73 -44.41 90.26 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-N 118.994 0.815 . . . . 0.0 111.118 -179.361 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -61.55 -53.16 59.96 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 124.377 1.071 . . . . 0.0 111.12 -179.856 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 3.7 tp10 -65.18 -36.18 83.39 Favored 'General case' 0 C--O 1.233 0.227 0 N-CA-C 113.419 0.896 . . . . 0.0 113.419 -177.137 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 30.3 t70 -67.83 -40.88 83.73 Favored 'General case' 0 CA--C 1.517 -0.322 0 N-CA-C 109.894 -0.41 . . . . 0.0 109.894 179.112 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 9.4 t -75.7 -14.05 60.33 Favored 'General case' 0 N--CA 1.452 -0.326 0 CA-C-N 115.784 -0.643 . . . . 0.0 111.68 -179.337 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 71.92 39.89 58.39 Favored Glycine 0 CA--C 1.526 0.733 0 N-CA-C 108.955 -1.658 . . . . 0.0 108.955 -178.876 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 84.2 mt -128.32 137.1 51.79 Favored 'General case' 0 N--CA 1.448 -0.552 0 N-CA-C 103.109 -2.922 . . . . 0.0 103.109 179.021 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 5.7 t -70.6 155.67 40.44 Favored 'General case' 0 C--N 1.319 -0.728 0 N-CA-C 106.053 -1.832 . . . . 0.0 106.053 178.226 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 74.3 t -52.73 -40.93 36.79 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.452 0 O-C-N 121.033 -1.042 . . . . 0.0 111.988 -179.601 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 65.3 p -61.97 -46.85 87.44 Favored 'General case' 0 N--CA 1.468 0.431 0 CA-C-N 119.494 1.043 . . . . 0.0 110.921 -179.855 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.88 -45.04 91.16 Favored 'General case' 0 C--O 1.219 -0.51 0 N-CA-C 108.238 -1.023 . . . . 0.0 108.238 178.311 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 92.5 t80 -54.35 -48.85 70.96 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 123.806 0.842 . . . . 0.0 109.928 -179.835 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 5.1 mm -56.45 -65.32 0.4 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.241 0 C-N-CA 125.051 1.34 . . . . 0.0 110.88 179.667 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 10.6 ptt180 -57.53 -39.96 77.74 Favored 'General case' 0 C--O 1.22 -0.463 0 CA-C-O 118.898 -0.572 . . . . 0.0 110.442 -178.833 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 8.9 t30 -58.31 -56.98 15.09 Favored 'General case' 0 N--CA 1.453 -0.277 0 C-N-CA 124.07 0.948 . . . . 0.0 109.298 179.432 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -60.11 -34.2 73.17 Favored 'General case' 0 CA--C 1.532 0.264 0 CA-C-O 121.362 0.601 . . . . 0.0 111.132 -179.797 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -67.74 -26.84 66.34 Favored 'General case' 0 CA--C 1.538 0.508 0 O-C-N 121.283 -0.886 . . . . 0.0 113.187 -179.885 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 6.1 mt -100.4 -31.59 11.24 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-N 119.32 0.964 . . . . 0.0 112.069 -178.652 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 38.4 m-80 . . . . . 0 C--O 1.247 0.958 0 C-N-CA 124.712 1.205 . . . . 0.0 108.134 179.583 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 6.0 t . . . . . 0 N--CA 1.437 -1.09 0 N-CA-C 107.066 -1.457 . . . . 0.0 107.066 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 2.4 t -101.07 154.39 4.68 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.911 0 N-CA-C 103.77 -2.678 . . . . 0.0 103.77 177.278 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 11.2 p -145.81 115.39 1.56 Allowed 'Isoleucine or valine' 0 N--CA 1.444 -0.73 0 N-CA-C 106.524 -1.658 . . . . 0.0 106.524 179.468 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 49.0 ttm-85 -152.96 161.19 42.84 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.615 0.721 . . . . 0.0 110.721 -179.63 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -96.92 110.88 23.3 Favored 'General case' 0 N--CA 1.446 -0.646 0 N-CA-C 105.484 -2.043 . . . . 0.0 105.484 179.219 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -109.17 108.89 19.7 Favored 'General case' 0 C--O 1.236 0.357 0 N-CA-C 106.537 -1.653 . . . . 0.0 106.537 -179.887 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 5.7 mtp180 -87.37 153.28 21.57 Favored 'General case' 0 C--N 1.334 -0.065 0 C-N-CA 122.73 0.412 . . . . 0.0 110.254 -179.916 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 22' ' ' PHE . . . . . . . . . . . . . 87.7 m-85 -141.2 143.77 34.39 Favored 'General case' 0 N--CA 1.468 0.471 0 N-CA-C 107.97 -1.122 . . . . 0.0 107.97 179.921 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 1.2 m -74.1 167.03 39.41 Favored Pre-proline 0 CA--C 1.538 0.499 0 CA-C-O 118.254 -0.879 . . . . 0.0 108.986 179.882 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 24' ' ' PRO . . . . . . . . . . . . . 61.0 Cg_endo -67.97 -33.2 26.71 Favored 'Trans proline' 0 C--N 1.346 0.427 0 C-N-CA 121.91 1.74 . . . . 0.0 112.283 -179.181 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 25' ' ' VAL . . . . . . . . . . . . . 61.9 t -64.8 -52.02 59.61 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.413 0 N-CA-C 107.847 -1.168 . . . . 0.0 107.847 179.637 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 1.4 mp0 -63.32 -44.55 94.62 Favored 'General case' 0 C--O 1.222 -0.368 0 C-N-CA 124.156 0.982 . . . . 0.0 110.477 179.276 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 27' ' ' ASP . . . . . . . . . . . . . 6.7 t70 -57.13 -45.22 83.67 Favored 'General case' 0 C--O 1.223 -0.298 0 C-N-CA 125.714 1.606 . . . . 0.0 111.446 -179.685 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 28' ' ' GLU . . . . . . . . . . . . . 46.3 tt0 -63.42 -46.52 85.98 Favored 'General case' 0 N--CA 1.448 -0.549 0 N-CA-C 108.614 -0.884 . . . . 0.0 108.614 178.866 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 52.0 m -62.27 -47.87 82.43 Favored 'General case' 0 C--N 1.333 -0.11 0 O-C-N 121.695 -0.628 . . . . 0.0 110.524 179.226 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 79.2 mt -63.37 -38.4 82.07 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.634 0 CA-C-O 122.415 1.102 . . . . 0.0 108.399 179.759 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 70.0 ttt180 -64.66 -38.3 90.52 Favored 'General case' 0 C--N 1.327 -0.378 0 O-C-N 118.881 -2.387 . . . . 0.0 109.29 178.226 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -71.8 -48.22 47.94 Favored 'General case' 0 C--N 1.33 -0.262 0 C-N-CA 123.937 0.895 . . . . 0.0 112.462 -179.151 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 12.7 mptt -66.45 -46.11 77.53 Favored 'General case' 0 C--O 1.225 -0.221 0 CA-C-O 118.026 -0.988 . . . . 0.0 108.604 -179.857 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 34' ' ' ALA . . . . . . . . . . . . . . . -53.7 -56.31 18.45 Favored 'General case' 0 CA--C 1.528 0.123 0 CA-C-N 119.317 0.962 . . . . 0.0 110.183 179.284 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 5.2 tp10 -63.17 -39.28 94.19 Favored 'General case' 0 C--O 1.232 0.153 0 N-CA-C 112.578 0.585 . . . . 0.0 112.578 -178.303 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 36' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -69.3 -35.57 76.12 Favored 'General case' 0 N--CA 1.46 0.055 0 CA-C-N 118.453 0.57 . . . . 0.0 110.355 179.622 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 37' ' ' SER . . . . . . . . . . . . . 13.9 t -75.92 -12.14 60.09 Favored 'General case' 0 CA--C 1.541 0.628 0 N-CA-C 108.911 -0.774 . . . . 0.0 108.911 178.234 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 75.44 29.6 59.68 Favored Glycine 0 C--N 1.339 0.696 0 O-C-N 121.126 -0.984 . . . . 0.0 110.74 -179.504 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 39' ' ' LEU . . . . . . . . . . . . . 87.6 mt -120.9 159.05 26.32 Favored 'General case' 0 N--CA 1.445 -0.71 0 C-N-CA 125.469 1.508 . . . . 0.0 107.929 179.425 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 40' ' ' THR . . . . . 0.495 HG23 ' H ' ' B' ' 43' ' ' ALA . 1.6 t -81.39 151.9 27.71 Favored 'General case' 0 C--N 1.322 -0.609 0 N-CA-C 104.109 -2.552 . . . . 0.0 104.109 176.799 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 41' ' ' VAL . . . . . . . . . . . . . 42.2 t -48.17 -42.09 10.73 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.659 0 C-N-CA 125.217 1.407 . . . . 0.0 109.627 178.516 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 42' ' ' SER . . . . . . . . . . . . . 13.2 p -60.37 -51.08 71.04 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-N 119.648 1.113 . . . . 0.0 111.39 179.465 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 43' ' ' ALA . . . . . 0.495 ' H ' HG23 ' B' ' 40' ' ' THR . . . -61.04 -42.85 99.25 Favored 'General case' 0 C--O 1.223 -0.302 0 C-N-CA 123.601 0.761 . . . . 0.0 109.023 179.193 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 44' ' ' TYR . . . . . . . . . . . . . 46.8 t80 -58.39 -50.63 72.98 Favored 'General case' 0 N--CA 1.445 -0.709 0 N-CA-C 109.444 -0.576 . . . . 0.0 109.444 179.486 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 45' ' ' ILE . . . . . . . . . . . . . 22.7 mm -55.44 -61.03 1.21 Allowed 'Isoleucine or valine' 0 C--N 1.34 0.189 0 C-N-CA 124.036 0.934 . . . . 0.0 110.214 179.762 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 46' ' ' ARG . . . . . . . . . . . . . 26.9 ptt180 -53.92 -49.11 69.37 Favored 'General case' 0 C--O 1.223 -0.33 0 CA-C-O 118.967 -0.54 . . . . 0.0 111.384 -178.566 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 47' ' ' ASN . . . . . . . . . . . . . 24.0 t30 -60.34 -51.76 68.14 Favored 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 124.195 0.998 . . . . 0.0 112.692 -179.075 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -61.45 -35.57 77.97 Favored 'General case' 0 C--O 1.222 -0.344 0 O-C-N 123.82 0.7 . . . . 0.0 111.528 -179.858 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 49' ' ' ALA . . . . . . . . . . . . . . . -77.07 -24.25 51.92 Favored 'General case' 0 N--CA 1.447 -0.595 0 N-CA-C 113.575 0.954 . . . . 0.0 113.575 -178.79 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 24.8 mt -84.96 -40.75 16.58 Favored 'General case' 0 CA--C 1.513 -0.47 0 CA-C-N 118.734 0.697 . . . . 0.0 111.172 -179.671 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 51' ' ' ASN . . . . . . . . . . . . . 69.5 m-80 . . . . . 0 C--O 1.247 0.924 0 CA-C-O 116.301 -1.809 . . . . 0.0 108.952 179.808 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 5.3 t . . . . . 0 N--CA 1.432 -1.364 0 N-CA-C 108.457 -0.942 . . . . 0.0 108.457 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 16.0 t -101.77 157.61 4.46 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.578 0 N-CA-C 106.445 -1.687 . . . . 0.0 106.445 178.611 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 7.2 p -151.16 107.58 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 N-CA-C 105.723 -1.954 . . . . 0.0 105.723 178.05 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 4.2 ttt85 -152.66 146.63 25.31 Favored 'General case' 0 C--O 1.235 0.334 0 O-C-N 122.085 -0.385 . . . . 0.0 111.669 -178.954 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -76.97 119.03 20.14 Favored 'General case' 0 N--CA 1.449 -0.484 0 N-CA-C 104.739 -2.319 . . . . 0.0 104.739 177.212 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 13.0 tp -123.62 113.14 18.28 Favored 'General case' 0 N--CA 1.442 -0.835 0 C-N-CA 123.275 0.63 . . . . 0.0 109.371 179.788 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 7.7 mtm180 -98.31 162.24 13.28 Favored 'General case' 0 N--CA 1.453 -0.281 0 C-N-CA 125.629 1.572 . . . . 0.0 111.384 179.846 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 78.0 m-85 -144.24 150.99 38.81 Favored 'General case' 0 CA--C 1.53 0.208 0 C-N-CA 125.817 1.647 . . . . 0.0 107.004 179.421 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -75.26 175.43 4.08 Favored Pre-proline 0 CA--C 1.551 1.012 0 CA-C-N 119.83 1.195 . . . . 0.0 108.859 179.329 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 43.6 Cg_endo -66.71 -43.38 7.43 Favored 'Trans proline' 0 C--N 1.35 0.634 0 CA-C-N 122.144 1.802 . . . . 0.0 113.067 -178.67 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 96.3 t -64.38 -41.71 93.17 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.218 0 N-CA-C 108.615 -0.883 . . . . 0.0 108.615 179.893 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -63.39 -47.75 80.73 Favored 'General case' 0 N--CA 1.452 -0.364 0 C-N-CA 123.664 0.785 . . . . 0.0 109.284 179.911 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 5.5 t70 -59.71 -49.91 75.91 Favored 'General case' 0 CA--C 1.507 -0.688 0 C-N-CA 125.837 1.655 . . . . 0.0 111.847 -179.898 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -62.29 -44.41 96.59 Favored 'General case' 0 N--CA 1.447 -0.613 0 N-CA-C 108.123 -1.066 . . . . 0.0 108.123 -179.64 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 30.8 m -61.17 -53.36 57.94 Favored 'General case' 0 N--CA 1.454 -0.265 0 N-CA-C 108.698 -0.852 . . . . 0.0 108.698 178.872 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 58.1 mt -58.16 -43.61 85.93 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.329 0 CA-C-N 119.038 0.835 . . . . 0.0 110.211 -179.644 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 23.2 ttt180 -63.22 -47.67 81.53 Favored 'General case' 0 C--N 1.332 -0.161 0 O-C-N 121.457 -0.777 . . . . 0.0 110.089 179.91 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 4.7 mptp? -63.71 -46.4 85.61 Favored 'General case' 0 C--O 1.225 -0.229 0 CA-C-N 118.82 0.736 . . . . 0.0 109.796 -179.786 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 13.5 mptt -64.82 -44.67 89.11 Favored 'General case' 0 CA--C 1.529 0.143 0 CA-C-O 118.057 -0.973 . . . . 0.0 110.237 -179.566 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -57.37 -56.14 25.67 Favored 'General case' 0 C--O 1.231 0.1 0 C-N-CA 124.656 1.183 . . . . 0.0 109.609 179.018 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 29.9 tt0 -60.63 -40.9 93.67 Favored 'General case' 0 N--CA 1.449 -0.488 0 C-N-CA 123.633 0.773 . . . . 0.0 112.132 -178.269 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 27.6 t70 -68.3 -30.27 69.22 Favored 'General case' 0 CA--C 1.53 0.173 0 C-N-CA 124.349 1.06 . . . . 0.0 110.138 179.449 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 10.1 t -82.18 -6.41 59.18 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 124.58 1.152 . . . . 0.0 109.375 178.153 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 69.2 29.27 72.12 Favored Glycine 0 CA--C 1.527 0.789 0 O-C-N 120.581 -1.325 . . . . 0.0 109.991 -179.265 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 75.9 mt -122.68 158.83 29.2 Favored 'General case' 0 N--CA 1.447 -0.597 0 C-N-CA 125.836 1.654 . . . . 0.0 108.137 179.99 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 40' ' ' THR . . . . . 0.427 HG23 ' H ' ' A' ' 43' ' ' ALA . 0.7 OUTLIER -84.91 147.49 26.73 Favored 'General case' 0 C--N 1.32 -0.704 0 N-CA-C 104.036 -2.579 . . . . 0.0 104.036 177.235 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 39.8 t -46.8 -41.05 5.06 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.478 0 C-N-CA 125.356 1.463 . . . . 0.0 110.241 178.494 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -60.75 -49.44 77.48 Favored 'General case' 0 CA--C 1.548 0.873 0 CA-C-N 119.622 1.101 . . . . 0.0 110.587 179.515 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.427 ' H ' HG23 ' A' ' 40' ' ' THR . . . -64.47 -41.84 96.26 Favored 'General case' 0 C--O 1.224 -0.261 0 C-N-CA 125.229 1.411 . . . . 0.0 110.203 178.898 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 81.3 t80 -58.35 -52.54 65.19 Favored 'General case' 0 N--CA 1.452 -0.347 0 N-CA-C 108.087 -1.079 . . . . 0.0 108.087 179.256 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 45' ' ' ILE . . . . . 0.461 HG23 HG23 ' B' ' 45' ' ' ILE . 16.6 mm -52.44 -59.8 1.4 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.298 0 C-N-CA 124.227 1.011 . . . . 0.0 110.698 179.499 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 29.5 ptt180 -59.05 -44.17 91.76 Favored 'General case' 0 C--O 1.222 -0.381 0 CA-C-O 118.72 -0.657 . . . . 0.0 112.304 -178.944 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 29.4 t30 -59.91 -52.35 65.8 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-N 118.657 0.662 . . . . 0.0 110.808 -178.922 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -62.99 -29.21 70.64 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 123.649 0.78 . . . . 0.0 111.502 179.438 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -80.5 -15.41 56.77 Favored 'General case' 0 CA--C 1.532 0.283 0 N-CA-C 113.791 1.034 . . . . 0.0 113.791 -179.677 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 31.0 mt -101.96 -42.89 5.95 Favored 'General case' 0 CA--C 1.522 -0.131 0 CA-C-N 120.173 1.351 . . . . 0.0 112.124 -179.606 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 60.8 m-80 . . . . . 0 C--O 1.245 0.836 0 O-C-N 124.159 0.912 . . . . 0.0 109.487 -179.437 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 5.4 t . . . . . 0 N--CA 1.436 -1.126 0 CA-C-O 122.234 1.016 . . . . 0.0 109.73 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 23.2 t -122.85 143.82 34.45 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.615 0 N-CA-C 105.537 -2.023 . . . . 0.0 105.537 179.234 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 6.4 p -143.74 97.66 0.58 Allowed 'Isoleucine or valine' 0 N--CA 1.443 -0.784 0 CA-C-O 122.471 1.129 . . . . 0.0 109.564 178.761 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 1.2 ttt85 -144.18 155.05 43.74 Favored 'General case' 0 N--CA 1.45 -0.463 0 CA-C-N 114.617 -1.174 . . . . 0.0 108.372 179.292 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -90.87 134.76 34.21 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 104.096 -2.557 . . . . 0.0 104.096 177.559 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 20' ' ' LEU . . . . . 0.407 ' HA ' HD12 ' B' ' 20' ' ' LEU . 11.3 tp -116.04 154.92 29.04 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-N 118.883 0.765 . . . . 0.0 109.673 179.497 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 18.4 mmt180 -126.54 150.28 48.89 Favored 'General case' 0 C--O 1.232 0.17 0 C-N-CA 125.762 1.625 . . . . 0.0 110.203 -178.93 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 22' ' ' PHE . . . . . . . . . . . . . 91.9 m-85 -145.82 143.91 29.94 Favored 'General case' 0 C--O 1.232 0.165 0 C-N-CA 125.587 1.555 . . . . 0.0 107.366 178.578 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 23' ' ' SER . . . . . 0.402 ' HB3' ' HD2' ' B' ' 24' ' ' PRO . 2.4 m -68.99 170.84 7.57 Favored Pre-proline 0 CA--C 1.542 0.652 0 CA-C-N 119.258 0.935 . . . . 0.0 109.997 179.323 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 24' ' ' PRO . . . . . 0.402 ' HD2' ' HB3' ' B' ' 23' ' ' SER . 36.8 Cg_endo -65.75 -44.81 7.43 Favored 'Trans proline' 0 C--N 1.349 0.584 0 C-N-CA 121.452 1.435 . . . . 0.0 113.139 -178.277 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 25' ' ' VAL . . . . . . . . . . . . . 21.8 t -65.87 -38.99 83.43 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.52 0 C-N-CA 123.918 0.887 . . . . 0.0 109.387 179.788 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 98.6 mt-10 -66.5 -40.93 89.52 Favored 'General case' 0 C--O 1.226 -0.173 0 C-N-CA 123.879 0.872 . . . . 0.0 108.858 179.488 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 27' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -62.89 -50.26 71.6 Favored 'General case' 0 CA--C 1.514 -0.412 0 C-N-CA 123.903 0.881 . . . . 0.0 109.518 179.195 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 28' ' ' GLU . . . . . . . . . . . . . 91.4 mt-10 -57.02 -43.35 81.78 Favored 'General case' 0 C--N 1.332 -0.191 0 C-N-CA 124.245 1.018 . . . . 0.0 109.542 178.689 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 80.0 m -63.23 -59.92 4.09 Favored 'General case' 0 N--CA 1.451 -0.421 0 N-CA-C 109.599 -0.519 . . . . 0.0 109.599 179.52 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 98.0 mt -58.09 -39.07 71.03 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.449 0 C-N-CA 123.961 0.904 . . . . 0.0 111.891 -178.686 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 24.1 ttt-85 -67.08 -48.4 68.34 Favored 'General case' 0 N--CA 1.453 -0.277 0 O-C-N 121.399 -0.813 . . . . 0.0 108.977 -179.855 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 2.1 mptp? -60.94 -46.98 88.52 Favored 'General case' 0 CA--C 1.515 -0.386 0 N-CA-C 108.82 -0.807 . . . . 0.0 108.82 -179.89 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 58.7 mmtt -63.59 -43.91 95.56 Favored 'General case' 0 C--O 1.22 -0.448 0 CA-C-O 118.053 -0.975 . . . . 0.0 110.619 -179.498 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 34' ' ' ALA . . . . . . . . . . . . . . . -58.21 -50.94 71.79 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 119.6 1.091 . . . . 0.0 109.237 178.618 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 27.6 tt0 -60.06 -45.03 94.23 Favored 'General case' 0 N--CA 1.454 -0.255 0 C-N-CA 124.144 0.977 . . . . 0.0 111.779 -179.185 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 36' ' ' ASP . . . . . . . . . . . . . 25.3 t0 -68.73 -37.53 79.53 Favored 'General case' 0 C--N 1.331 -0.215 0 C-N-CA 125.332 1.453 . . . . 0.0 110.418 -179.362 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 37' ' ' SER . . . . . . . . . . . . . 32.8 t -73.0 -11.2 60.48 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 126.409 1.884 . . . . 0.0 110.04 178.723 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 68.33 26.89 74.02 Favored Glycine 0 CA--C 1.525 0.689 0 O-C-N 121.246 -0.909 . . . . 0.0 111.259 -179.447 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 39' ' ' LEU . . . . . . . . . . . . . 82.2 mt -121.17 142.29 50.03 Favored 'General case' 0 N--CA 1.445 -0.678 0 C-N-CA 125.2 1.4 . . . . 0.0 107.588 -179.717 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 40' ' ' THR . . . . . . . . . . . . . 2.0 t -64.61 146.31 54.86 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 105.367 -2.086 . . . . 0.0 105.367 177.036 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 41' ' ' VAL . . . . . . . . . . . . . 2.2 t -45.94 -51.27 3.65 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.469 0 C-N-CA 124.748 1.219 . . . . 0.0 111.538 179.303 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 42' ' ' SER . . . . . . . . . . . . . 1.5 p -58.09 -31.54 67.21 Favored 'General case' 0 CA--C 1.544 0.741 0 O-C-N 120.325 -1.485 . . . . 0.0 112.686 -179.199 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -78.46 -40.8 34.57 Favored 'General case' 0 C--O 1.224 -0.256 0 C-N-CA 124.694 1.198 . . . . 0.0 109.047 177.71 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 44' ' ' TYR . . . . . . . . . . . . . 24.6 t80 -57.37 -51.85 67.74 Favored 'General case' 0 N--CA 1.455 -0.224 0 N-CA-C 108.409 -0.959 . . . . 0.0 108.409 179.442 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 45' ' ' ILE . . . . . 0.461 HG23 HG23 ' A' ' 45' ' ' ILE . 28.0 mm -54.16 -60.67 1.27 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.309 0 C-N-CA 123.358 0.663 . . . . 0.0 111.676 179.499 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 46' ' ' ARG . . . . . . . . . . . . . 9.9 ptt180 -56.48 -43.19 79.39 Favored 'General case' 0 C--O 1.224 -0.264 0 CA-C-O 119.171 -0.442 . . . . 0.0 111.23 -178.519 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 47' ' ' ASN . . . . . . . . . . . . . 39.0 t30 -60.41 -55.93 27.63 Favored 'General case' 0 N--CA 1.446 -0.642 0 C-N-CA 123.885 0.874 . . . . 0.0 111.944 -179.198 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -60.2 -33.33 72.09 Favored 'General case' 0 CA--C 1.53 0.185 0 O-C-N 124.17 0.919 . . . . 0.0 112.564 -179.069 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 49' ' ' ALA . . . . . . . . . . . . . . . -74.0 -24.33 59.57 Favored 'General case' 0 C--N 1.333 -0.145 0 N-CA-C 113.986 1.106 . . . . 0.0 113.986 -178.929 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 24.0 mt -100.19 -43.13 6.41 Favored 'General case' 0 CA--C 1.514 -0.407 0 N-CA-C 113.423 0.897 . . . . 0.0 113.423 -178.672 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 51' ' ' ASN . . . . . . . . . . . . . 26.6 m-80 . . . . . 0 C--O 1.249 1.062 0 C-N-CA 125.179 1.392 . . . . 0.0 107.649 -177.514 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 4.7 t . . . . . 0 N--CA 1.446 -0.635 0 N-CA-C 107.266 -1.383 . . . . 0.0 107.266 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 13.5 t -131.32 157.98 43.26 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 N-CA-C 106.01 -1.848 . . . . 0.0 106.01 -179.673 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 13.6 p -149.16 116.98 0.9 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.444 0 N-CA-C 106.881 -1.525 . . . . 0.0 106.881 178.898 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 25.1 ttt180 -153.26 161.22 42.63 Favored 'General case' 0 N--CA 1.466 0.339 0 O-C-N 121.691 -0.631 . . . . 0.0 110.153 -179.847 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -106.32 127.79 53.51 Favored 'General case' 0 C--O 1.24 0.58 0 N-CA-C 105.052 -2.203 . . . . 0.0 105.052 179.102 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -128.24 120.31 26.92 Favored 'General case' 0 CA--C 1.529 0.162 0 C-N-CA 124.284 1.034 . . . . 0.0 109.602 -178.448 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 15.6 mmt85 -83.84 156.97 22.2 Favored 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 124.811 1.244 . . . . 0.0 110.665 -179.768 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 70.6 m-85 -144.61 155.31 43.56 Favored 'General case' 0 N--CA 1.463 0.224 0 C-N-CA 125.355 1.462 . . . . 0.0 108.315 178.55 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' SER . . . . . 0.457 ' HB3' ' HD2' ' A' ' 24' ' ' PRO . 39.1 m -79.9 171.08 13.34 Favored Pre-proline 0 CA--C 1.545 0.783 0 C-N-CA 123.976 0.91 . . . . 0.0 108.904 179.095 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 24' ' ' PRO . . . . . 0.457 ' HD2' ' HB3' ' A' ' 23' ' ' SER . 35.0 Cg_endo -64.75 -54.61 0.68 Allowed 'Trans proline' 0 C--N 1.351 0.674 0 C-N-CA 121.961 1.774 . . . . 0.0 112.027 -178.012 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 33.7 t -58.91 -42.02 84.68 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.337 0 C-N-CA 123.359 0.664 . . . . 0.0 110.013 -179.716 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -63.55 -50.24 70.29 Favored 'General case' 0 C--O 1.227 -0.092 0 C-N-CA 123.289 0.635 . . . . 0.0 110.856 -179.576 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 7.1 t70 -59.65 -47.04 87.18 Favored 'General case' 0 C--O 1.221 -0.398 0 C-N-CA 123.859 0.864 . . . . 0.0 110.224 179.218 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 44.8 tt0 -58.18 -44.71 88.15 Favored 'General case' 0 N--CA 1.449 -0.523 0 C-N-CA 124.628 1.171 . . . . 0.0 109.217 179.945 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 68.7 m -60.42 -52.18 66.32 Favored 'General case' 0 CA--C 1.538 0.51 0 N-CA-C 108.793 -0.818 . . . . 0.0 108.793 178.886 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 72.3 mt -59.26 -45.99 92.63 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.211 0 C-N-CA 123.379 0.672 . . . . 0.0 109.752 -179.684 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 62.8 ttt180 -61.06 -40.98 95.7 Favored 'General case' 0 C--O 1.234 0.255 0 C-N-CA 124.237 1.015 . . . . 0.0 110.308 -179.525 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -68.34 -52.65 31.0 Favored 'General case' 0 CA--C 1.52 -0.201 0 CA-C-N 118.644 0.656 . . . . 0.0 110.33 179.461 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 75.9 mttt -60.99 -43.44 98.85 Favored 'General case' 0 CA--C 1.518 -0.262 0 CA-C-N 119.021 0.828 . . . . 0.0 111.122 -178.584 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -56.82 -54.16 49.64 Favored 'General case' 0 N--CA 1.452 -0.337 0 C-N-CA 123.936 0.894 . . . . 0.0 109.477 179.235 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 31.3 tt0 -62.82 -41.46 99.33 Favored 'General case' 0 N--CA 1.455 -0.185 0 N-CA-C 112.908 0.707 . . . . 0.0 112.908 -178.516 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -62.95 -39.3 94.22 Favored 'General case' 0 N--CA 1.453 -0.309 0 C-N-CA 125.451 1.501 . . . . 0.0 108.574 179.449 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 8.7 t -78.89 -9.76 59.59 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 123.815 0.846 . . . . 0.0 109.967 177.776 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 64.71 27.08 71.51 Favored Glycine 0 N--CA 1.442 -0.928 0 C-N-CA 125.955 1.74 . . . . 0.0 112.078 -179.458 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 13.3 mt -118.3 138.1 52.61 Favored 'General case' 0 CA--C 1.518 -0.287 0 N-CA-C 103.851 -2.648 . . . . 0.0 103.851 179.292 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 40' ' ' THR . . . . . 0.453 HG23 ' H ' ' A' ' 43' ' ' ALA . 5.5 t -56.4 151.85 12.4 Favored 'General case' 0 CA--C 1.534 0.333 0 N-CA-C 108.968 -0.753 . . . . 0.0 108.968 178.942 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 24.4 t -52.14 -37.1 21.57 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.363 0 N-CA-C 109.106 -0.702 . . . . 0.0 109.106 177.865 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 12.2 m -62.09 -30.46 71.02 Favored 'General case' 0 CA--C 1.541 0.605 0 O-C-N 121.138 -0.976 . . . . 0.0 112.646 179.893 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.453 ' H ' HG23 ' A' ' 40' ' ' THR . . . -81.82 -46.51 14.07 Favored 'General case' 0 CA--C 1.516 -0.356 0 N-CA-C 106.535 -1.654 . . . . 0.0 106.535 177.852 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 82.0 t80 -51.39 -52.68 43.71 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 124.091 0.956 . . . . 0.0 109.327 -179.684 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 13.1 mm -53.0 -64.01 0.43 Allowed 'Isoleucine or valine' 0 C--N 1.34 0.173 0 C-N-CA 126.079 1.752 . . . . 0.0 110.801 179.479 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -54.61 -47.95 72.78 Favored 'General case' 0 C--O 1.22 -0.487 0 CA-C-O 119.133 -0.461 . . . . 0.0 111.305 -178.2 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 11.3 t30 -58.76 -49.79 76.35 Favored 'General case' 0 N--CA 1.445 -0.713 0 C-N-CA 123.455 0.702 . . . . 0.0 112.427 -178.877 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -64.98 -31.97 73.46 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 123.388 0.675 . . . . 0.0 111.146 179.337 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -75.86 -35.65 59.85 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 124.156 0.982 . . . . 0.0 113.05 -179.742 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.454 HD21 ' HA ' ' B' ' 26' ' ' GLU . 22.5 mt -77.54 -44.56 28.18 Favored 'General case' 0 CA--C 1.515 -0.398 0 N-CA-C 113.817 1.043 . . . . 0.0 113.817 -177.81 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 57.9 m-80 . . . . . 0 C--O 1.249 1.047 0 CA-C-O 117.774 -1.108 . . . . 0.0 111.233 179.632 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 2.9 t . . . . . 0 N--CA 1.445 -0.713 0 N-CA-C 107.391 -1.337 . . . . 0.0 107.391 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 2.9 t -141.02 154.54 21.1 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.719 0 N-CA-C 106.432 -1.692 . . . . 0.0 106.432 179.24 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 14.0 p -141.53 114.51 4.37 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.646 0 N-CA-C 106.725 -1.583 . . . . 0.0 106.725 178.579 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 7.9 ttt180 -149.26 148.56 29.71 Favored 'General case' 0 N--CA 1.47 0.553 0 N-CA-C 108.166 -1.05 . . . . 0.0 108.166 178.691 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 2.6 m -101.2 116.66 33.33 Favored 'General case' 0 C--O 1.236 0.376 0 N-CA-C 107.982 -1.118 . . . . 0.0 107.982 -179.614 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -115.28 159.96 20.36 Favored 'General case' 0 C--O 1.235 0.296 0 C-N-CA 124.412 1.085 . . . . 0.0 109.97 -179.508 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 1.5 mtt85 -125.99 162.9 24.19 Favored 'General case' 0 N--CA 1.443 -0.787 0 C-N-CA 124.711 1.204 . . . . 0.0 110.721 178.439 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 22' ' ' PHE . . . . . . . . . . . . . 92.9 m-85 -140.65 146.66 38.18 Favored 'General case' 0 N--CA 1.454 -0.27 0 C-N-CA 124.985 1.314 . . . . 0.0 107.996 179.749 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 14.8 m -73.91 168.75 23.06 Favored Pre-proline 0 CA--C 1.548 0.887 0 N-CA-C 106.714 -1.587 . . . . 0.0 106.714 178.276 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 24' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_endo -63.0 -44.27 16.41 Favored 'Trans proline' 0 N--CA 1.459 -0.523 0 C-N-CA 121.456 1.437 . . . . 0.0 112.825 -178.112 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 25' ' ' VAL . . . . . . . . . . . . . 75.1 t -64.87 -40.22 88.33 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.276 0 C-N-CA 123.894 0.878 . . . . 0.0 110.168 179.609 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 26' ' ' GLU . . . . . 0.454 ' HA ' HD21 ' A' ' 50' ' ' LEU . 81.9 mt-10 -62.76 -51.05 68.66 Favored 'General case' 0 N--CA 1.453 -0.316 0 N-CA-C 109.494 -0.558 . . . . 0.0 109.494 -179.343 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 27' ' ' ASP . . . . . . . . . . . . . 17.7 t70 -59.28 -47.48 85.2 Favored 'General case' 0 CA--C 1.511 -0.543 0 C-N-CA 125.165 1.386 . . . . 0.0 111.428 179.875 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 28' ' ' GLU . . . . . . . . . . . . . 73.2 tt0 -57.6 -46.91 83.46 Favored 'General case' 0 N--CA 1.447 -0.594 0 C-N-CA 124.589 1.156 . . . . 0.0 109.108 179.421 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 55.9 m -61.82 -57.86 10.22 Favored 'General case' 0 CA--C 1.533 0.323 0 N-CA-C 109.618 -0.512 . . . . 0.0 109.618 179.067 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 90.2 mt -53.92 -46.13 64.19 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.1 0 C-N-CA 123.539 0.736 . . . . 0.0 110.671 -178.066 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 63.0 ttt180 -61.14 -47.92 83.98 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-O 118.688 -0.672 . . . . 0.0 110.72 -179.665 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -65.24 -46.32 81.04 Favored 'General case' 0 CA--C 1.517 -0.302 0 CA-C-O 118.617 -0.706 . . . . 0.0 110.214 -179.073 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 65.1 mttt -59.22 -47.82 83.93 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-N 118.935 0.789 . . . . 0.0 110.276 -179.497 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 34' ' ' ALA . . . . . . . . . . . . . . . -57.86 -56.45 21.82 Favored 'General case' 0 N--CA 1.45 -0.457 0 C-N-CA 124.229 1.011 . . . . 0.0 110.248 179.802 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 17.4 tt0 -62.94 -34.6 77.82 Favored 'General case' 0 C--N 1.33 -0.253 0 C-N-CA 123.796 0.839 . . . . 0.0 112.783 -177.681 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 36' ' ' ASP . . . . . . . . . . . . . 5.3 t70 -67.94 -42.36 81.12 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 108.263 -1.014 . . . . 0.0 108.263 178.715 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 37' ' ' SER . . . . . . . . . . . . . 31.8 t -71.98 -27.0 62.47 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-O 121.244 0.545 . . . . 0.0 109.861 179.412 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 97.72 -4.05 61.26 Favored Glycine 0 CA--C 1.523 0.541 0 C-N-CA 125.203 1.382 . . . . 0.0 111.877 -179.712 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 39' ' ' LEU . . . . . . . . . . . . . 31.8 mt -87.85 144.29 26.67 Favored 'General case' 0 N--CA 1.438 -1.038 0 C-N-CA 125.255 1.422 . . . . 0.0 107.168 -179.959 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 40' ' ' THR . . . . . . . . . . . . . 1.8 t -68.39 147.25 52.35 Favored 'General case' 0 C--N 1.313 -0.988 0 N-CA-C 106.039 -1.837 . . . . 0.0 106.039 177.56 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 41' ' ' VAL . . . . . . . . . . . . . 53.7 t -49.88 -38.26 13.77 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.446 0 O-C-N 121.524 -0.735 . . . . 0.0 110.926 179.144 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 42' ' ' SER . . . . . . . . . . . . . 14.1 p -61.67 -37.78 85.33 Favored 'General case' 0 CA--C 1.533 0.327 0 O-C-N 121.071 -1.018 . . . . 0.0 111.836 179.651 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -73.73 -43.3 59.54 Favored 'General case' 0 C--N 1.341 0.211 0 C-N-CA 125.802 1.641 . . . . 0.0 108.3 178.492 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 44' ' ' TYR . . . . . . . . . . . . . 47.2 t80 -56.08 -50.01 72.2 Favored 'General case' 0 N--CA 1.451 -0.378 0 C-N-CA 123.721 0.809 . . . . 0.0 109.323 179.489 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 45' ' ' ILE . . . . . . . . . . . . . 12.8 mm -52.56 -63.93 0.43 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.291 0 C-N-CA 124.786 1.235 . . . . 0.0 110.727 179.765 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 46' ' ' ARG . . . . . . . . . . . . . 15.2 ptp180 -55.36 -48.06 74.83 Favored 'General case' 0 C--O 1.226 -0.161 0 C-N-CA 123.602 0.761 . . . . 0.0 112.081 -179.5 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 47' ' ' ASN . . . . . . . . . . . . . 29.9 t30 -59.42 -53.17 61.19 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-O 118.717 -0.659 . . . . 0.0 111.141 -179.347 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -63.28 -32.76 74.26 Favored 'General case' 0 C--O 1.224 -0.24 0 C-N-CA 123.753 0.821 . . . . 0.0 112.283 -179.574 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 49' ' ' ALA . . . . . . . . . . . . . . . -68.62 -37.03 79.42 Favored 'General case' 0 C--O 1.232 0.167 0 O-C-N 121.758 -0.589 . . . . 0.0 111.145 179.931 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 21.4 mt -79.8 -41.36 26.62 Favored 'General case' 0 CA--C 1.521 -0.147 0 CA-C-O 119.1 -0.476 . . . . 0.0 110.439 -179.687 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 51' ' ' ASN . . . . . . . . . . . . . 57.5 m-80 . . . . . 0 C--O 1.253 1.286 0 C-N-CA 124.335 1.054 . . . . 0.0 111.295 -178.492 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 4.0 t . . . . . 0 N--CA 1.446 -0.637 0 CA-C-O 121.769 0.795 . . . . 0.0 108.883 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 2.4 t -119.05 156.48 21.12 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 C-N-CA 125.954 1.701 . . . . 0.0 106.623 178.485 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 14.8 p -144.47 123.47 6.72 Favored 'Isoleucine or valine' 0 C--O 1.238 0.499 0 N-CA-C 106.73 -1.582 . . . . 0.0 106.73 178.928 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 13.7 ttm180 -154.51 164.92 37.95 Favored 'General case' 0 C--O 1.234 0.266 0 O-C-N 121.674 -0.641 . . . . 0.0 109.516 179.416 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 3.8 m -107.84 135.32 49.44 Favored 'General case' 0 N--CA 1.448 -0.542 0 N-CA-C 105.327 -2.101 . . . . 0.0 105.327 178.721 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 43.9 mt -129.91 108.76 10.37 Favored 'General case' 0 CA--C 1.512 -0.513 0 N-CA-C 108.584 -0.895 . . . . 0.0 108.584 179.293 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -77.86 150.32 34.19 Favored 'General case' 0 N--CA 1.45 -0.462 0 N-CA-C 107.213 -1.403 . . . . 0.0 107.213 177.555 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 66.6 m-85 -144.02 161.74 38.0 Favored 'General case' 0 C--O 1.237 0.433 0 N-CA-C 106.508 -1.664 . . . . 0.0 106.508 178.185 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 23' ' ' SER . . . . . 0.413 ' HB3' ' HD2' ' A' ' 24' ' ' PRO . 36.7 m -92.71 167.6 14.21 Favored Pre-proline 0 CA--C 1.538 0.483 0 C-N-CA 124.58 1.152 . . . . 0.0 109.407 179.453 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 24' ' ' PRO . . . . . 0.413 ' HD2' ' HB3' ' A' ' 23' ' ' SER . 55.4 Cg_endo -63.01 -29.81 75.82 Favored 'Trans proline' 0 C--N 1.347 0.45 0 C-N-CA 122.861 2.374 . . . . 0.0 113.306 -178.808 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 71.6 t -68.63 -54.61 19.99 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.455 0 N-CA-C 107.381 -1.34 . . . . 0.0 107.381 179.134 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 28.0 mt-10 -59.45 -44.08 93.04 Favored 'General case' 0 C--O 1.223 -0.302 0 C-N-CA 125.231 1.412 . . . . 0.0 110.58 179.964 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -62.13 -48.54 79.69 Favored 'General case' 0 CA--C 1.512 -0.489 0 C-N-CA 125.667 1.587 . . . . 0.0 110.919 179.984 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 76.7 tt0 -59.69 -42.4 92.89 Favored 'General case' 0 N--CA 1.453 -0.284 0 N-CA-C 108.509 -0.923 . . . . 0.0 108.509 178.486 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 18.8 m -62.26 -60.31 3.77 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 123.461 0.704 . . . . 0.0 109.559 -179.932 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 96.5 mt -57.87 -39.54 71.83 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.163 0 C-N-CA 124.195 0.998 . . . . 0.0 111.064 -178.965 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 19.8 ttt180 -69.36 -37.11 77.46 Favored 'General case' 0 C--N 1.332 -0.186 0 O-C-N 120.907 -1.12 . . . . 0.0 110.675 -179.81 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 2.2 mptp? -70.15 -49.24 52.55 Favored 'General case' 0 CA--C 1.517 -0.29 0 N-CA-C 109.385 -0.598 . . . . 0.0 109.385 178.973 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 3.2 mptp? -63.81 -46.48 84.97 Favored 'General case' 0 CA--C 1.511 -0.521 0 C-N-CA 124.478 1.111 . . . . 0.0 110.682 -178.462 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -59.27 -53.96 52.3 Favored 'General case' 0 N--CA 1.452 -0.368 0 CA-C-N 119.137 0.881 . . . . 0.0 109.794 179.611 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 41.9 tt0 -62.45 -38.06 88.3 Favored 'General case' 0 CA--C 1.532 0.282 0 N-CA-C 112.011 0.374 . . . . 0.0 112.011 -178.099 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 31.6 t70 -69.64 -37.95 76.97 Favored 'General case' 0 C--O 1.233 0.228 0 C-N-CA 123.535 0.734 . . . . 0.0 109.878 179.194 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 10.4 t -72.37 -8.04 52.84 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 124.224 1.01 . . . . 0.0 108.639 177.802 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 71.03 6.72 60.99 Favored Glycine 0 C--N 1.341 0.86 0 C-N-CA 126.098 1.808 . . . . 0.0 113.108 -179.488 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 15.3 mt -101.66 161.05 13.93 Favored 'General case' 0 N--CA 1.441 -0.888 0 C-N-CA 126.161 1.784 . . . . 0.0 107.127 -179.491 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 40' ' ' THR . . . . . 0.496 HG23 ' H ' ' A' ' 43' ' ' ALA . 5.1 t -81.04 155.16 26.48 Favored 'General case' 0 C--N 1.313 -1.012 0 O-C-N 120.42 -1.425 . . . . 0.0 107.641 178.781 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 20.8 t -51.65 -39.75 24.41 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.407 0 C-N-CA 124.87 1.268 . . . . 0.0 110.099 178.659 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 15.2 p -61.44 -50.46 72.7 Favored 'General case' 0 CA--C 1.534 0.35 0 O-C-N 121.907 -0.496 . . . . 0.0 109.987 179.303 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.496 ' H ' HG23 ' A' ' 40' ' ' THR . . . -59.86 -48.84 80.05 Favored 'General case' 0 CA--C 1.519 -0.217 0 C-N-CA 125.737 1.615 . . . . 0.0 109.959 178.997 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 81.9 t80 -51.14 -49.56 60.61 Favored 'General case' 0 N--CA 1.45 -0.47 0 C-N-CA 124.814 1.246 . . . . 0.0 109.803 -179.873 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 13.9 mm -57.67 -65.01 0.46 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.394 0 C-N-CA 124.067 0.947 . . . . 0.0 110.62 179.373 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 7.2 ptp180 -53.81 -41.65 67.54 Favored 'General case' 0 C--N 1.341 0.198 0 CA-C-O 117.886 -1.054 . . . . 0.0 111.906 -178.424 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 28.9 t30 -61.88 -55.89 25.02 Favored 'General case' 0 N--CA 1.453 -0.312 0 C-N-CA 124.014 0.926 . . . . 0.0 110.127 179.68 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -61.5 -29.55 70.05 Favored 'General case' 0 C--O 1.224 -0.248 0 C-N-CA 123.176 0.59 . . . . 0.0 112.288 -179.133 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -77.6 -26.38 50.62 Favored 'General case' 0 N--CA 1.451 -0.412 0 N-CA-C 113.148 0.796 . . . . 0.0 113.148 179.885 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 18.5 mt -88.92 -42.69 11.67 Favored 'General case' 0 CA--C 1.514 -0.413 0 O-C-N 121.031 -1.043 . . . . 0.0 109.346 -179.679 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 5.5 m-80 . . . . . 0 C--O 1.242 0.683 0 O-C-N 124.628 1.205 . . . . 0.0 107.883 179.461 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 1.3 t . . . . . 0 N--CA 1.443 -0.784 0 CA-C-O 122.152 0.977 . . . . 0.0 110.923 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 41.0 t -117.76 146.66 21.94 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 C-N-CA 126.813 2.045 . . . . 0.0 105.902 179.02 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 7.2 p -146.07 107.76 0.77 Allowed 'Isoleucine or valine' 0 N--CA 1.451 -0.418 0 N-CA-C 105.343 -2.095 . . . . 0.0 105.343 178.326 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 9.8 ttt180 -149.52 166.43 29.21 Favored 'General case' 0 CA--C 1.509 -0.633 0 N-CA-C 109.978 -0.378 . . . . 0.0 109.978 -179.739 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 19.2 m -105.49 145.7 30.54 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 108.282 -1.007 . . . . 0.0 108.282 179.699 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 26.7 mt -135.5 143.5 45.84 Favored 'General case' 0 N--CA 1.443 -0.816 0 N-CA-C 106.481 -1.674 . . . . 0.0 106.481 177.405 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -114.91 143.2 45.52 Favored 'General case' 0 N--CA 1.448 -0.526 0 N-CA-C 105.434 -2.061 . . . . 0.0 105.434 178.976 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 22' ' ' PHE . . . . . . . . . . . . . 95.8 m-85 -136.46 140.98 43.5 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 106.145 -1.798 . . . . 0.0 106.145 179.632 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 4.6 m -74.87 169.08 21.76 Favored Pre-proline 0 CA--C 1.543 0.699 0 C-N-CA 123.33 0.652 . . . . 0.0 109.272 179.802 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 24' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo -67.06 -28.92 40.85 Favored 'Trans proline' 0 C--N 1.348 0.525 0 C-N-CA 122.025 1.817 . . . . 0.0 113.573 -178.294 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 25' ' ' VAL . . . . . . . . . . . . . 46.8 t -74.51 -48.34 35.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 N-CA-C 107.38 -1.341 . . . . 0.0 107.38 -179.666 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 26.8 mp0 -59.51 -43.28 93.42 Favored 'General case' 0 N--CA 1.448 -0.566 0 C-N-CA 125.071 1.348 . . . . 0.0 109.206 179.181 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 27' ' ' ASP . . . . . . . . . . . . . 19.3 t70 -63.65 -50.27 69.96 Favored 'General case' 0 C--O 1.224 -0.246 0 C-N-CA 124.252 1.021 . . . . 0.0 109.84 179.136 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 28' ' ' GLU . . . . . . . . . . . . . 64.1 tt0 -60.89 -17.21 49.33 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 125.138 1.375 . . . . 0.0 110.915 179.254 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 27.2 m -91.92 -61.44 1.63 Allowed 'General case' 0 N--CA 1.453 -0.317 0 N-CA-C 107.671 -1.233 . . . . 0.0 107.671 178.427 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 96.4 mt -58.17 -29.34 36.86 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.484 0 C-N-CA 124.109 0.964 . . . . 0.0 112.462 -178.388 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 61.8 ttt180 -73.58 -32.19 64.0 Favored 'General case' 0 C--N 1.328 -0.355 0 O-C-N 120.358 -1.464 . . . . 0.0 110.185 -179.959 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 3.7 mptp? -81.03 -50.51 9.58 Favored 'General case' 0 N--CA 1.456 -0.135 0 C-N-CA 123.584 0.754 . . . . 0.0 112.274 -179.475 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 4.6 mptp? -61.15 -42.06 97.88 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-O 118.95 -0.547 . . . . 0.0 110.785 -177.847 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 34' ' ' ALA . . . . . . . . . . . . . . . -60.1 -54.55 44.56 Favored 'General case' 0 N--CA 1.455 -0.213 0 C-N-CA 124.155 0.982 . . . . 0.0 108.794 179.614 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 16.4 tt0 -61.14 -36.38 79.63 Favored 'General case' 0 CA--C 1.532 0.273 0 N-CA-C 112.435 0.532 . . . . 0.0 112.435 -178.522 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 36' ' ' ASP . . . . . . . . . . . . . 5.8 t70 -70.85 -34.16 71.37 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 124.095 0.958 . . . . 0.0 110.279 178.88 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 37' ' ' SER . . . . . . . . . . . . . 9.6 t -79.69 -6.0 56.32 Favored 'General case' 0 N--CA 1.453 -0.309 0 C-N-CA 124.207 1.003 . . . . 0.0 111.906 179.388 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 68.03 20.55 72.9 Favored Glycine 0 CA--C 1.534 1.237 0 N-CA-C 110.642 -0.983 . . . . 0.0 110.642 -178.299 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 39' ' ' LEU . . . . . . . . . . . . . 55.4 mt -115.61 128.84 56.23 Favored 'General case' 0 CA--C 1.514 -0.413 0 N-CA-C 104.994 -2.224 . . . . 0.0 104.994 179.943 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 40' ' ' THR . . . . . . . . . . . . . 1.2 t -63.38 152.9 36.81 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 107.659 -1.237 . . . . 0.0 107.659 178.987 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 41' ' ' VAL . . . . . . . . . . . . . 40.2 t -47.64 -40.8 7.73 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.638 0 C-N-CA 124.454 1.102 . . . . 0.0 110.455 178.366 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 42' ' ' SER . . . . . . . . . . . . . 9.8 m -63.35 -36.62 84.3 Favored 'General case' 0 CA--C 1.546 0.791 0 O-C-N 119.827 -1.795 . . . . 0.0 111.667 179.809 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -74.82 -45.57 42.52 Favored 'General case' 0 C--O 1.223 -0.294 0 C-N-CA 125.612 1.565 . . . . 0.0 110.687 178.766 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 44' ' ' TYR . . . . . . . . . . . . . 4.1 t80 -55.89 -41.07 73.91 Favored 'General case' 0 CA--C 1.537 0.444 0 CA-C-N 119.158 0.89 . . . . 0.0 109.42 179.527 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 45' ' ' ILE . . . . . . . . . . . . . 13.2 mm -57.63 -64.31 0.55 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.37 0 CA-C-N 118.847 0.749 . . . . 0.0 109.763 178.897 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 46' ' ' ARG . . . . . . . . . . . . . 12.8 ptp180 -56.0 -46.53 78.71 Favored 'General case' 0 C--O 1.219 -0.508 0 CA-C-O 118.257 -0.878 . . . . 0.0 111.368 -179.15 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 47' ' ' ASN . . . . . . . . . . . . . 35.3 t30 -54.69 -54.43 41.92 Favored 'General case' 0 N--CA 1.452 -0.33 0 CA-C-N 118.989 0.813 . . . . 0.0 110.678 -179.557 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -64.13 -29.58 70.69 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 123.82 0.848 . . . . 0.0 112.35 -179.955 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 49' ' ' ALA . . . . . . . . . . . . . . . -78.75 -14.82 59.07 Favored 'General case' 0 CA--C 1.53 0.186 0 C-N-CA 124.372 1.069 . . . . 0.0 113.277 -179.557 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 11.8 mt -112.83 -35.4 5.48 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-N 119.241 0.928 . . . . 0.0 113.15 -179.264 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 51' ' ' ASN . . . . . . . . . . . . . 70.3 m-80 . . . . . 0 CA--C 1.5 -0.978 0 CA-C-O 116.339 -1.791 . . . . 0.0 112.279 -177.503 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 5.8 t . . . . . 0 N--CA 1.444 -0.754 0 CA-C-O 122.323 1.059 . . . . 0.0 108.803 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 20.3 t -96.57 145.39 8.85 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.621 0 N-CA-C 104.603 -2.369 . . . . 0.0 104.603 178.062 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 8.0 p -143.38 107.45 1.23 Allowed 'Isoleucine or valine' 0 C--O 1.238 0.485 0 N-CA-C 104.909 -2.256 . . . . 0.0 104.909 178.295 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 10.0 ttt85 -141.94 162.14 36.21 Favored 'General case' 0 C--O 1.237 0.411 0 CA-C-O 121.423 0.63 . . . . 0.0 111.826 -179.251 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 42.0 m -92.12 103.43 15.92 Favored 'General case' 0 N--CA 1.445 -0.7 0 N-CA-C 105.144 -2.169 . . . . 0.0 105.144 179.503 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.457 HD12 ' HA ' ' A' ' 20' ' ' LEU . 18.6 tp -110.58 111.64 22.99 Favored 'General case' 0 C--N 1.323 -0.553 0 C-N-CA 123.931 0.893 . . . . 0.0 108.75 179.836 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 11.5 mmm-85 -94.51 150.96 19.73 Favored 'General case' 0 N--CA 1.451 -0.38 0 C-N-CA 124.637 1.175 . . . . 0.0 109.879 179.785 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 87.2 m-85 -128.82 179.09 5.91 Favored 'General case' 0 C--O 1.237 0.412 0 C-N-CA 125.853 1.661 . . . . 0.0 108.096 178.457 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 23' ' ' SER . . . . . 0.485 ' HB3' ' HD2' ' A' ' 24' ' ' PRO . 62.6 m -112.06 173.94 2.59 Favored Pre-proline 0 CA--C 1.543 0.687 0 CA-C-O 117.563 -1.208 . . . . 0.0 109.041 179.853 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 24' ' ' PRO . . . . . 0.485 ' HD2' ' HB3' ' A' ' 23' ' ' SER . 45.1 Cg_endo -68.51 -48.9 0.96 Allowed 'Trans proline' 0 C--N 1.35 0.617 0 CA-C-N 121.557 1.592 . . . . 0.0 113.478 -177.15 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 20.4 t -66.17 -37.2 79.21 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.432 0 N-CA-C 109.657 -0.498 . . . . 0.0 109.657 -179.499 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 49.8 mt-10 -64.62 -50.86 65.49 Favored 'General case' 0 C--N 1.341 0.212 0 N-CA-C 108.788 -0.819 . . . . 0.0 108.788 179.636 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 6.0 t70 -57.52 -45.34 85.11 Favored 'General case' 0 CA--C 1.513 -0.463 0 C-N-CA 124.972 1.309 . . . . 0.0 110.617 179.642 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -60.51 -46.19 91.06 Favored 'General case' 0 N--CA 1.45 -0.437 0 C-N-CA 123.296 0.638 . . . . 0.0 109.438 179.703 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 27.8 m -60.7 -57.08 14.2 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 123.179 0.592 . . . . 0.0 109.94 179.671 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 40.5 mt -58.03 -43.13 84.43 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.317 0 C-N-CA 124.927 1.291 . . . . 0.0 110.992 -178.815 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 43.5 ttt180 -62.29 -48.2 80.92 Favored 'General case' 0 CA--C 1.516 -0.363 0 C-N-CA 123.359 0.663 . . . . 0.0 110.499 -179.604 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -63.91 -46.11 86.27 Favored 'General case' 0 CA--C 1.518 -0.251 0 C-N-CA 120.659 -0.416 . . . . 0.0 110.09 -178.842 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 8.2 tptm -63.7 -44.63 93.07 Favored 'General case' 0 N--CA 1.455 -0.181 0 CA-C-O 119.615 -0.231 . . . . 0.0 110.993 -179.349 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -59.93 -51.64 68.82 Favored 'General case' 0 N--CA 1.454 -0.254 0 C-N-CA 124.041 0.936 . . . . 0.0 110.579 179.754 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 39.2 tt0 -64.65 -36.66 84.96 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-O 119.113 -0.47 . . . . 0.0 110.829 -179.053 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 27.5 t70 -67.69 -43.98 78.82 Favored 'General case' 0 CA--C 1.518 -0.267 0 C-N-CA 123.954 0.902 . . . . 0.0 109.802 179.147 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 31.2 t -73.23 -14.79 61.4 Favored 'General case' 0 CA--C 1.542 0.663 0 CA-C-O 122.105 0.955 . . . . 0.0 109.645 179.025 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 77.88 8.73 87.26 Favored Glycine 0 N--CA 1.443 -0.894 0 O-C-N 120.542 -1.349 . . . . 0.0 114.829 178.902 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 15.0 mt -114.41 118.36 33.62 Favored 'General case' 0 CA--C 1.515 -0.403 0 N-CA-C 103.742 -2.688 . . . . 0.0 103.742 179.252 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 12.7 t -48.13 158.75 0.23 Allowed 'General case' 0 C--N 1.329 -0.3 0 C-N-CA 124.811 1.244 . . . . 0.0 111.569 -179.292 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 69.7 t -46.06 -44.29 5.23 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.342 0 C-N-CA 125.038 1.335 . . . . 0.0 112.02 -178.885 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 11.8 p -62.72 -41.62 99.25 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-N 120.498 1.499 . . . . 0.0 111.848 -179.994 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -67.71 -49.98 59.87 Favored 'General case' 0 C--O 1.218 -0.569 0 N-CA-C 108.106 -1.072 . . . . 0.0 108.106 178.222 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 45.8 t80 -52.22 -51.38 58.59 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 123.963 0.905 . . . . 0.0 108.647 179.28 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 45' ' ' ILE . . . . . 0.45 HG23 HG23 ' B' ' 45' ' ' ILE . 6.2 mm -55.61 -62.62 0.76 Allowed 'Isoleucine or valine' 0 C--O 1.225 -0.194 0 C-N-CA 125.704 1.602 . . . . 0.0 110.744 179.608 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 21.4 ptt180 -59.13 -45.7 90.24 Favored 'General case' 0 C--O 1.222 -0.343 0 CA-C-O 119.07 -0.491 . . . . 0.0 111.626 -178.162 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 21.7 t30 -58.25 -52.43 65.59 Favored 'General case' 0 N--CA 1.45 -0.464 0 C-N-CA 124.222 1.009 . . . . 0.0 111.099 -178.905 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -67.97 -25.62 65.53 Favored 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 124.333 1.053 . . . . 0.0 112.148 179.736 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -80.71 -41.97 22.72 Favored 'General case' 0 N--CA 1.454 -0.261 0 CA-C-N 118.428 0.558 . . . . 0.0 111.444 179.699 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 27.9 mt -73.2 -45.11 58.16 Favored 'General case' 0 CA--C 1.516 -0.355 0 C-N-CA 123.561 0.745 . . . . 0.0 111.809 -178.96 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 68.2 m-80 . . . . . 0 C--O 1.251 1.14 0 CA-C-O 116.961 -1.495 . . . . 0.0 111.136 -178.421 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 13.1 t . . . . . 0 N--CA 1.443 -0.822 0 CA-C-O 122.516 1.151 . . . . 0.0 111.428 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 2.6 t -143.73 91.22 0.41 Allowed 'Isoleucine or valine' 0 N--CA 1.441 -0.915 0 N-CA-C 103.757 -2.682 . . . . 0.0 103.757 178.378 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 8.1 p -92.27 118.6 38.15 Favored 'Isoleucine or valine' 0 C--O 1.239 0.528 0 N-CA-C 104.332 -2.47 . . . . 0.0 104.332 178.459 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 13.1 ttt85 -145.58 176.57 9.52 Favored 'General case' 0 C--O 1.233 0.229 0 O-C-N 121.432 -0.792 . . . . 0.0 109.732 -178.783 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 25.7 m -114.98 90.19 3.28 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 105.487 -2.042 . . . . 0.0 105.487 -179.546 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -95.06 106.12 18.09 Favored 'General case' 0 C--N 1.324 -0.533 0 C-N-CA 124.474 1.11 . . . . 0.0 108.176 -179.126 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 12.0 mtm180 -91.52 155.9 18.07 Favored 'General case' 0 C--O 1.238 0.467 0 CA-C-N 118.342 0.519 . . . . 0.0 111.357 178.892 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 22' ' ' PHE . . . . . . . . . . . . . 96.8 m-85 -136.44 143.97 44.17 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 107.801 -1.185 . . . . 0.0 107.801 179.796 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -75.21 168.17 30.07 Favored Pre-proline 0 CA--C 1.543 0.694 0 C-N-CA 123.555 0.742 . . . . 0.0 109.888 179.45 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 24' ' ' PRO . . . . . . . . . . . . . 34.2 Cg_endo -61.35 -40.83 45.91 Favored 'Trans proline' 0 C--N 1.348 0.541 0 C-N-CA 122.808 2.338 . . . . 0.0 113.283 -177.921 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 25' ' ' VAL . . . . . . . . . . . . . 38.5 t -72.15 -33.57 47.16 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.491 0 N-CA-C 109.271 -0.64 . . . . 0.0 109.271 179.562 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 68.6 mt-10 -65.94 -46.07 79.53 Favored 'General case' 0 C--N 1.343 0.316 0 N-CA-C 107.802 -1.184 . . . . 0.0 107.802 178.722 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 27' ' ' ASP . . . . . . . . . . . . . 4.0 t0 -58.9 -48.71 80.48 Favored 'General case' 0 CA--C 1.512 -0.494 0 C-N-CA 127.022 2.129 . . . . 0.0 110.075 179.216 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 28' ' ' GLU . . . . . . . . . . . . . 71.8 tt0 -56.38 -51.03 69.83 Favored 'General case' 0 N--CA 1.455 -0.204 0 CA-C-N 118.892 0.769 . . . . 0.0 109.874 179.53 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 60.8 m -60.94 -56.6 19.21 Favored 'General case' 0 N--CA 1.451 -0.422 0 C-N-CA 122.591 0.356 . . . . 0.0 110.934 -178.846 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 97.8 mt -57.26 -49.87 78.5 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.477 0 C-N-CA 123.001 0.52 . . . . 0.0 111.091 -178.57 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 53.2 ttt180 -59.84 -44.82 93.87 Favored 'General case' 0 CA--C 1.521 -0.171 0 CA-C-N 119.143 0.883 . . . . 0.0 111.284 -179.462 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.42 -45.48 87.39 Favored 'General case' 0 CA--C 1.51 -0.596 0 CA-C-O 118.765 -0.636 . . . . 0.0 110.693 -178.927 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 17.9 tptm -67.26 -46.96 72.13 Favored 'General case' 0 N--CA 1.453 -0.277 0 N-CA-C 109.61 -0.515 . . . . 0.0 109.61 -179.351 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 34' ' ' ALA . . . . . . . . . . . . . . . -56.86 -54.79 42.43 Favored 'General case' 0 N--CA 1.453 -0.292 0 C-N-CA 125.318 1.447 . . . . 0.0 112.693 -179.705 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 5.4 tt0 -70.2 -26.71 64.01 Favored 'General case' 0 C--O 1.233 0.235 0 N-CA-C 112.205 0.446 . . . . 0.0 112.205 -177.372 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 36' ' ' ASP . . . . . . . . . . . . . 15.0 t70 -75.04 -42.54 56.94 Favored 'General case' 0 C--N 1.331 -0.236 0 O-C-N 121.553 -0.717 . . . . 0.0 109.091 178.255 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 37' ' ' SER . . . . . . . . . . . . . 39.6 t -69.83 -23.81 63.36 Favored 'General case' 0 C--O 1.235 0.324 0 C-N-CA 126.017 1.727 . . . . 0.0 111.32 -179.812 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 81.09 23.18 59.65 Favored Glycine 0 CA--C 1.53 0.997 0 N-CA-C 110.355 -1.098 . . . . 0.0 110.355 -178.689 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 39' ' ' LEU . . . . . . . . . . . . . 57.8 mt -120.68 95.08 4.57 Favored 'General case' 0 N--CA 1.447 -0.62 1 N-CA-C 99.827 -4.138 . . . . 0.0 99.827 178.446 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 40' ' ' THR . . . . . . . . . . . . . 4.6 t -48.82 158.83 0.28 Allowed 'General case' 0 N--CA 1.457 -0.102 0 C-N-CA 122.783 0.433 . . . . 0.0 110.358 -178.952 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 41' ' ' VAL . . . . . . . . . . . . . 97.9 t -41.49 -47.9 0.83 Allowed 'Isoleucine or valine' 0 N--CA 1.447 -0.601 0 C-N-CA 124.221 1.008 . . . . 0.0 112.914 -176.828 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 42' ' ' SER . . . . . . . . . . . . . 2.5 p -65.43 -45.75 82.62 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 117.694 -1.603 . . . . 0.0 112.701 -179.403 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -61.02 -45.3 95.37 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 125.346 1.458 . . . . 0.0 110.389 179.225 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 44' ' ' TYR . . . . . . . . . . . . . 9.8 t80 -60.44 -46.29 90.57 Favored 'General case' 0 C--O 1.222 -0.342 0 C-N-CA 123.768 0.827 . . . . 0.0 109.861 179.456 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 45' ' ' ILE . . . . . 0.45 HG23 HG23 ' A' ' 45' ' ' ILE . 19.0 mm -57.67 -61.51 1.28 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.355 0 CA-C-N 119.656 1.116 . . . . 0.0 110.228 179.689 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 46' ' ' ARG . . . . . . . . . . . . . 21.7 ptt180 -53.65 -47.51 70.28 Favored 'General case' 0 CA--C 1.528 0.133 0 CA-C-O 119.373 -0.346 . . . . 0.0 111.641 -178.792 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 47' ' ' ASN . . . . . . . . . . . . . 41.9 t30 -64.33 -49.67 70.82 Favored 'General case' 0 C--O 1.234 0.286 0 N-CA-C 114.117 1.154 . . . . 0.0 114.117 -178.989 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -68.1 -21.31 64.97 Favored 'General case' 0 C--O 1.23 0.069 0 C-N-CA 124.19 0.996 . . . . 0.0 112.365 -179.344 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 49' ' ' ALA . . . . . . . . . . . . . . . -87.19 -40.3 14.7 Favored 'General case' 0 N--CA 1.451 -0.404 0 CA-C-N 118.587 0.63 . . . . 0.0 110.975 179.719 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 39.4 mt -68.29 -48.69 64.32 Favored 'General case' 0 C--O 1.233 0.208 0 O-C-N 121.612 -0.68 . . . . 0.0 112.834 -179.055 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 51' ' ' ASN . . . . . . . . . . . . . 44.2 m-80 . . . . . 0 C--O 1.247 0.922 0 CA-C-O 117.445 -1.264 . . . . 0.0 112.565 -177.026 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 3.2 t . . . . . 0 N--CA 1.445 -0.687 0 N-CA-C 107.12 -1.437 . . . . 0.0 107.12 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 16' ' ' VAL . . . . . 0.401 HG21 ' CG ' ' B' ' 27' ' ' ASP . 3.7 t -131.62 144.3 37.86 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 N-CA-C 106.038 -1.838 . . . . 0.0 106.038 178.435 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 9.4 p -135.61 103.53 4.01 Favored 'Isoleucine or valine' 0 C--O 1.238 0.487 0 N-CA-C 105.931 -1.877 . . . . 0.0 105.931 179.49 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 30.9 ttm180 -139.27 151.09 46.19 Favored 'General case' 0 CA--C 1.514 -0.438 0 CA-C-N 115.005 -0.998 . . . . 0.0 109.516 -179.706 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 19.4 m -103.05 144.6 31.08 Favored 'General case' 0 N--CA 1.449 -0.507 0 N-CA-C 107.344 -1.354 . . . . 0.0 107.344 -179.845 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 54.4 mt -133.32 142.33 48.4 Favored 'General case' 0 C--O 1.236 0.353 0 CA-C-O 121.902 0.858 . . . . 0.0 109.334 179.44 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 10.8 mmt85 -102.18 141.59 34.78 Favored 'General case' 0 N--CA 1.451 -0.389 0 C-N-CA 126.707 2.003 . . . . 0.0 106.809 178.898 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 95.0 m-85 -140.6 143.58 35.33 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 105.418 -2.067 . . . . 0.0 105.418 179.342 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 1.7 m -78.72 165.28 50.61 Favored Pre-proline 0 CA--C 1.539 0.526 0 N-CA-C 108.298 -1.001 . . . . 0.0 108.298 179.851 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -67.5 -21.14 46.86 Favored 'Trans proline' 0 CA--C 1.535 0.539 0 C-N-CA 122.018 1.812 . . . . 0.0 112.107 -179.642 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 16.0 t -82.89 -20.87 9.35 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.409 0 C-N-CA 125.07 1.348 . . . . 0.0 110.687 -179.686 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 93.6 mt-10 -92.61 -46.64 7.5 Favored 'General case' 0 CA--C 1.531 0.23 0 N-CA-C 107.047 -1.464 . . . . 0.0 107.047 178.782 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 2.9 t70 -55.69 -52.7 62.97 Favored 'General case' 0 CA--C 1.507 -0.693 0 C-N-CA 128.601 2.76 . . . . 0.0 112.817 179.792 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -60.99 -38.66 86.79 Favored 'General case' 0 N--CA 1.45 -0.447 0 C-N-CA 119.451 -0.9 . . . . 0.0 110.209 -178.508 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 89.5 m -64.96 -53.01 53.0 Favored 'General case' 0 N--CA 1.451 -0.376 0 CA-C-O 118.83 -0.605 . . . . 0.0 109.628 179.015 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 78.2 mt -56.57 -43.7 79.14 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.203 0 N-CA-C 109.06 -0.718 . . . . 0.0 109.06 -179.708 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 55.2 ttt180 -61.82 -50.6 71.66 Favored 'General case' 0 N--CA 1.455 -0.2 0 C-N-CA 123.734 0.814 . . . . 0.0 110.792 179.402 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 2.4 mptm? -61.86 -46.81 87.84 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-N 118.747 0.703 . . . . 0.0 110.257 -179.101 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 26.0 mmtp -63.74 -45.01 91.83 Favored 'General case' 0 C--O 1.227 -0.124 0 CA-C-N 118.655 0.661 . . . . 0.0 110.322 -179.799 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -60.57 -46.55 89.79 Favored 'General case' 0 C--O 1.237 0.413 0 C-N-CA 123.733 0.813 . . . . 0.0 110.424 179.753 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 27.7 tt0 -67.14 -39.65 86.62 Favored 'General case' 0 N--CA 1.454 -0.263 0 O-C-N 121.849 -0.532 . . . . 0.0 110.815 -179.564 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -67.58 -44.27 78.55 Favored 'General case' 0 N--CA 1.456 -0.168 0 O-C-N 121.747 -0.596 . . . . 0.0 110.347 -179.999 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 6.8 t -69.53 -17.29 63.57 Favored 'General case' 0 N--CA 1.449 -0.516 0 C-N-CA 124.553 1.141 . . . . 0.0 111.764 -178.602 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 75.43 26.42 65.76 Favored Glycine 0 CA--C 1.53 1.001 0 CA-C-N 118.853 0.751 . . . . 0.0 111.353 -179.969 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 88.6 mt -127.78 114.21 16.96 Favored 'General case' 0 N--CA 1.454 -0.233 0 C-N-CA 127.46 2.304 . . . . 0.0 105.517 179.902 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 9.4 t -52.22 154.9 2.16 Favored 'General case' 0 CA--C 1.536 0.421 0 CA-C-N 119.397 0.998 . . . . 0.0 109.664 179.747 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 53.6 t -46.78 -41.95 5.54 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.311 0 C-N-CA 125.407 1.483 . . . . 0.0 112.011 -179.052 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 7.1 p -63.86 -48.84 75.12 Favored 'General case' 0 CA--C 1.541 0.599 0 CA-C-N 119.599 1.09 . . . . 0.0 110.822 179.557 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -62.2 -45.56 92.84 Favored 'General case' 0 C--O 1.223 -0.293 0 C-N-CA 124.837 1.255 . . . . 0.0 109.509 178.621 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 71.6 t80 -54.92 -50.38 68.96 Favored 'General case' 0 N--CA 1.452 -0.351 0 C-N-CA 125.056 1.343 . . . . 0.0 108.802 179.308 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 8.3 mm -56.44 -63.59 0.6 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.316 0 C-N-CA 124.229 1.012 . . . . 0.0 110.505 179.406 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 25.8 ptt180 -55.53 -41.47 73.2 Favored 'General case' 0 N--CA 1.466 0.333 0 O-C-N 121.607 -0.683 . . . . 0.0 111.807 -178.657 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 22.2 t30 -60.81 -53.47 56.93 Favored 'General case' 0 N--CA 1.453 -0.321 0 C-N-CA 123.81 0.844 . . . . 0.0 110.944 179.803 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -63.82 -32.02 73.39 Favored 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 123.532 0.733 . . . . 0.0 112.375 -179.58 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -73.06 -28.73 62.48 Favored 'General case' 0 CA--C 1.531 0.222 0 N-CA-C 113.366 0.876 . . . . 0.0 113.366 -179.317 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 19.2 mt -92.23 -34.74 14.15 Favored 'General case' 0 C--O 1.236 0.381 0 O-C-N 121.912 -0.493 . . . . 0.0 110.758 -179.592 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 28.8 m-80 . . . . . 0 C--O 1.249 1.044 0 C-N-CA 124.438 1.095 . . . . 0.0 108.848 179.896 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 1.9 t . . . . . 0 N--CA 1.444 -0.747 0 N-CA-C 107.717 -1.216 . . . . 0.0 107.717 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 38.9 t -108.38 153.89 9.81 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.687 0 N-CA-C 105.884 -1.895 . . . . 0.0 105.884 178.332 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 9.8 p -150.24 103.48 0.33 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.555 0 N-CA-C 107.826 -1.176 . . . . 0.0 107.826 178.885 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 15.7 ttm180 -146.55 152.75 39.46 Favored 'General case' 0 C--N 1.328 -0.344 0 O-C-N 121.355 -0.84 . . . . 0.0 109.783 -179.932 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 7.1 m -96.72 140.08 31.83 Favored 'General case' 0 N--CA 1.448 -0.529 0 C-N-CA 125.446 1.498 . . . . 0.0 108.169 179.322 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 95.0 mt -123.06 165.73 16.31 Favored 'General case' 0 C--O 1.236 0.38 0 N-CA-C 106.965 -1.494 . . . . 0.0 106.965 178.213 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 1.9 mmt85 -125.22 143.92 50.71 Favored 'General case' 0 C--O 1.239 0.525 0 C-N-CA 126.565 1.946 . . . . 0.0 108.34 179.531 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 22' ' ' PHE . . . . . . . . . . . . . 97.4 m-85 -141.41 141.9 33.74 Favored 'General case' 0 CA--C 1.516 -0.347 0 N-CA-C 105.407 -2.071 . . . . 0.0 105.407 179.75 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 4.9 m -79.75 165.0 50.47 Favored Pre-proline 0 C--N 1.324 -0.531 0 CA-C-O 118.432 -0.794 . . . . 0.0 109.171 -179.482 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 24' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -67.27 -5.32 13.55 Favored 'Trans proline' 0 CA--C 1.537 0.645 0 C-N-CA 122.9 2.4 . . . . 0.0 113.165 179.811 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 25' ' ' VAL . . . . . . . . . . . . . 55.4 t -93.85 -61.75 1.99 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.487 0 N-CA-C 104.934 -2.247 . . . . 0.0 104.934 178.713 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 63.6 mt-10 -53.84 -48.12 70.28 Favored 'General case' 0 N--CA 1.455 -0.217 0 C-N-CA 126.186 1.795 . . . . 0.0 110.961 -179.528 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 27' ' ' ASP . . . . . 0.401 ' CG ' HG21 ' A' ' 16' ' ' VAL . 15.5 t70 -61.25 -50.68 72.08 Favored 'General case' 0 CA--C 1.511 -0.526 0 C-N-CA 124.81 1.244 . . . . 0.0 112.048 -179.841 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 28' ' ' GLU . . . . . . . . . . . . . 5.4 tp10 -60.26 -43.57 96.04 Favored 'General case' 0 N--CA 1.449 -0.478 0 N-CA-C 108.645 -0.872 . . . . 0.0 108.645 -179.318 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 53.4 m -59.37 -54.36 47.59 Favored 'General case' 0 N--CA 1.452 -0.339 0 N-CA-C 108.731 -0.84 . . . . 0.0 108.731 178.902 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 71.3 mt -58.53 -43.96 88.15 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.317 0 C-N-CA 123.194 0.597 . . . . 0.0 110.191 -179.524 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 31.5 ttt180 -56.3 -49.44 74.29 Favored 'General case' 0 C--N 1.333 -0.147 0 C-N-CA 123.929 0.891 . . . . 0.0 109.624 179.711 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 1.4 mptm? -67.4 -43.07 82.21 Favored 'General case' 0 C--O 1.223 -0.309 0 CA-C-O 117.758 -1.115 . . . . 0.0 110.757 -179.572 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 29.3 mmtp -63.11 -44.14 96.49 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-N 119.842 1.201 . . . . 0.0 110.665 -179.559 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 34' ' ' ALA . . . . . . . . . . . . . . . -59.32 -56.6 20.02 Favored 'General case' 0 N--CA 1.451 -0.423 0 C-N-CA 124.8 1.24 . . . . 0.0 109.158 179.63 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -61.77 -37.94 86.18 Favored 'General case' 0 C--O 1.236 0.364 0 C-N-CA 123.389 0.676 . . . . 0.0 112.024 -178.688 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 36' ' ' ASP . . . . . . . . . . . . . 9.3 t70 -64.54 -40.7 96.08 Favored 'General case' 0 C--N 1.332 -0.153 0 C-N-CA 125.337 1.455 . . . . 0.0 108.655 178.785 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 37' ' ' SER . . . . . . . . . . . . . 6.2 t -77.78 -8.36 57.9 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 123.738 0.815 . . . . 0.0 110.453 179.013 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 69.45 24.17 76.22 Favored Glycine 0 CA--C 1.531 1.041 0 O-C-N 121.053 -1.029 . . . . 0.0 110.733 -178.991 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 39' ' ' LEU . . . . . . . . . . . . . 71.7 mt -115.99 128.07 55.44 Favored 'General case' 0 N--CA 1.447 -0.595 0 C-N-CA 126.313 1.845 . . . . 0.0 107.399 -179.239 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 40' ' ' THR . . . . . . . . . . . . . 3.5 t -57.31 145.28 32.69 Favored 'General case' 0 CA--C 1.538 0.51 0 N-CA-C 106.717 -1.586 . . . . 0.0 106.717 177.747 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 41' ' ' VAL . . . . . . . . . . . . . 94.1 t -49.8 -41.09 16.63 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.28 0 O-C-N 120.772 -1.205 . . . . 0.0 112.106 -178.735 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 42' ' ' SER . . . . . . . . . . . . . 11.3 m -61.64 -40.75 96.0 Favored 'General case' 0 CA--C 1.541 0.61 0 CA-C-N 119.768 1.167 . . . . 0.0 111.373 -179.648 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -68.59 -44.09 75.08 Favored 'General case' 0 C--O 1.22 -0.477 0 C-N-CA 124.389 1.076 . . . . 0.0 108.097 178.13 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 44' ' ' TYR . . . . . . . . . . . . . 70.6 t80 -55.22 -51.99 64.81 Favored 'General case' 0 N--CA 1.454 -0.254 0 N-CA-C 108.726 -0.842 . . . . 0.0 108.726 179.393 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 45' ' ' ILE . . . . . . . . . . . . . 19.3 mm -53.24 -64.65 0.38 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.23 0 C-N-CA 124.328 1.051 . . . . 0.0 111.47 179.545 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 46' ' ' ARG . . . . . . . . . . . . . 27.1 ptt180 -58.11 -42.06 84.92 Favored 'General case' 0 C--O 1.223 -0.331 0 CA-C-O 118.745 -0.645 . . . . 0.0 111.716 -177.978 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 47' ' ' ASN . . . . . . . . . . . . . 43.8 t30 -60.92 -54.84 40.16 Favored 'General case' 0 N--CA 1.45 -0.474 0 CA-C-O 118.655 -0.688 . . . . 0.0 110.216 -179.72 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -58.78 -31.31 68.27 Favored 'General case' 0 CA--C 1.53 0.201 0 C-N-CA 124.03 0.932 . . . . 0.0 111.56 -179.783 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 49' ' ' ALA . . . . . . . . . . . . . . . -74.86 -20.89 59.55 Favored 'General case' 0 N--CA 1.454 -0.273 0 N-CA-C 113.267 0.84 . . . . 0.0 113.267 -179.708 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 11.8 mt -107.91 -29.02 9.27 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 119.417 1.008 . . . . 0.0 111.592 -179.41 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 51' ' ' ASN . . . . . . . . . . . . . 73.0 m-20 . . . . . 0 C--O 1.245 0.855 0 C-N-CA 126.41 1.884 . . . . 0.0 109.817 -178.99 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 4.3 t . . . . . 0 N--CA 1.445 -0.691 0 CA-C-O 121.466 0.65 . . . . 0.0 109.409 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 16' ' ' VAL . . . . . 0.424 HG21 ' HB2' ' B' ' 27' ' ' ASP . 1.4 t -125.62 102.76 10.8 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.457 0 C-N-CA 123.562 0.745 . . . . 0.0 110.187 -177.9 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 3.1 p -101.25 127.51 54.45 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.412 0 C-N-CA 124.133 0.973 . . . . 0.0 110.872 -178.035 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 14.8 ttm180 -154.66 160.92 41.71 Favored 'General case' 0 C--O 1.237 0.399 0 N-CA-C 108.771 -0.826 . . . . 0.0 108.771 178.045 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 7.1 m -90.76 91.61 8.45 Favored 'General case' 0 C--O 1.237 0.401 0 N-CA-C 107.473 -1.306 . . . . 0.0 107.473 179.565 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -97.84 100.78 12.15 Favored 'General case' 0 C--O 1.236 0.393 0 N-CA-C 107.568 -1.271 . . . . 0.0 107.568 179.147 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 32.9 mtt180 -87.57 159.03 18.75 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 108.992 -0.744 . . . . 0.0 108.992 179.585 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 86.0 m-85 -136.58 152.02 50.01 Favored 'General case' 0 CA--C 1.511 -0.535 0 N-CA-C 108.151 -1.055 . . . . 0.0 108.151 -179.765 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -82.88 171.83 10.84 Favored Pre-proline 0 CA--C 1.539 0.525 0 N-CA-C 107.48 -1.304 . . . . 0.0 107.48 179.664 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -67.24 -37.26 18.68 Favored 'Trans proline' 0 N--CA 1.457 -0.66 0 C-N-CA 121.483 1.455 . . . . 0.0 112.712 -178.473 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 92.3 t -66.58 -53.06 39.2 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.324 0 N-CA-C 107.825 -1.176 . . . . 0.0 107.825 179.508 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 -57.84 -47.24 83.25 Favored 'General case' 0 N--CA 1.455 -0.182 0 C-N-CA 122.941 0.496 . . . . 0.0 110.443 179.576 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 21.7 t70 -59.54 -52.27 66.29 Favored 'General case' 0 CA--C 1.507 -0.676 0 C-N-CA 123.147 0.579 . . . . 0.0 111.257 -179.979 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -56.1 -38.54 70.89 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 118.351 0.523 . . . . 0.0 110.594 -179.456 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 25.9 m -67.05 -56.48 9.9 Favored 'General case' 0 N--CA 1.449 -0.495 0 C-N-CA 123.359 0.664 . . . . 0.0 109.874 179.527 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 88.2 mt -60.16 -38.89 78.85 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.252 0 C-N-CA 123.834 0.854 . . . . 0.0 109.758 -179.394 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 64.4 ttt180 -61.86 -51.72 67.05 Favored 'General case' 0 C--O 1.223 -0.293 0 C-N-CA 124.857 1.263 . . . . 0.0 108.341 179.217 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 2.6 mptp? -59.42 -48.97 79.61 Favored 'General case' 0 CA--C 1.515 -0.381 0 C-N-CA 123.305 0.642 . . . . 0.0 109.529 179.78 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 64.4 mmtt -60.88 -45.72 93.47 Favored 'General case' 0 CA--C 1.509 -0.626 0 CA-C-O 118.565 -0.731 . . . . 0.0 111.871 -178.943 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -63.41 -53.71 48.12 Favored 'General case' 0 N--CA 1.446 -0.665 0 O-C-N 123.595 0.559 . . . . 0.0 110.161 -179.256 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -61.13 -36.88 80.91 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 123.378 0.671 . . . . 0.0 111.824 -177.866 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -73.41 -33.77 65.13 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 125.331 1.452 . . . . 0.0 109.696 178.752 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 30.0 t -72.71 -13.69 61.4 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 125.079 1.352 . . . . 0.0 108.09 177.55 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 82.95 -9.88 59.06 Favored Glycine 0 C--N 1.338 0.694 0 C-N-CA 125.639 1.59 . . . . 0.0 111.784 -179.01 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 82.6 mt -86.3 173.25 9.86 Favored 'General case' 0 N--CA 1.439 -0.98 0 C-N-CA 126.0 1.72 . . . . 0.0 107.222 179.745 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -96.51 157.09 16.06 Favored 'General case' 0 C--N 1.317 -0.844 0 N-CA-C 104.548 -2.389 . . . . 0.0 104.548 177.362 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 84.3 t -51.01 -40.9 21.51 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.382 0 C-N-CA 123.635 0.774 . . . . 0.0 109.503 178.731 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 10.5 p -60.99 -45.05 96.35 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-N 120.428 1.467 . . . . 0.0 112.012 -179.652 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -66.68 -48.39 69.47 Favored 'General case' 0 C--O 1.225 -0.185 0 C-N-CA 123.973 0.909 . . . . 0.0 109.523 179.104 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 87.9 t80 -56.52 -47.13 80.01 Favored 'General case' 0 CA--C 1.538 0.503 0 N-CA-C 109.584 -0.524 . . . . 0.0 109.584 179.819 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 5.9 mm -54.58 -64.45 0.44 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.357 0 C-N-CA 124.896 1.278 . . . . 0.0 110.592 179.477 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 13.1 ptm180 -56.08 -45.06 79.49 Favored 'General case' 0 C--O 1.219 -0.5 0 CA-C-O 118.97 -0.538 . . . . 0.0 110.889 -178.744 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 43.0 t30 -59.28 -54.91 41.45 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-N 118.405 0.548 . . . . 0.0 111.901 -179.299 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -61.81 -29.93 70.48 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 123.813 0.845 . . . . 0.0 111.596 -179.603 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -75.0 -23.06 58.18 Favored 'General case' 0 C--O 1.223 -0.291 0 N-CA-C 113.615 0.969 . . . . 0.0 113.615 179.84 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 6.9 mt -99.93 -39.1 8.33 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 119.62 1.1 . . . . 0.0 112.174 -178.643 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 22.0 m-80 . . . . . 0 C--O 1.254 1.325 0 CA-C-O 116.329 -1.796 . . . . 0.0 113.187 -178.817 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 4.6 t . . . . . 0 N--CA 1.449 -0.505 0 N-CA-C 108.202 -1.036 . . . . 0.0 108.202 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 24.7 t -116.28 148.18 19.17 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.504 0 N-CA-C 106.524 -1.658 . . . . 0.0 106.524 179.146 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 10.7 p -141.25 106.26 1.7 Allowed 'Isoleucine or valine' 0 N--CA 1.447 -0.614 0 N-CA-C 107.299 -1.371 . . . . 0.0 107.299 177.644 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 33.0 ttm180 -136.51 159.74 40.88 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.32 -0.855 . . . . 0.0 109.228 179.911 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 11.6 m -97.38 87.62 4.19 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 107.42 -1.326 . . . . 0.0 107.42 -179.78 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -81.82 105.49 12.99 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 108.812 -0.81 . . . . 0.0 108.812 -179.806 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 10.1 mtm180 -93.7 142.28 27.54 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 126.56 1.944 . . . . 0.0 110.918 -179.885 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 22' ' ' PHE . . . . . . . . . . . . . 78.0 m-85 -129.56 170.52 13.65 Favored 'General case' 0 N--CA 1.482 1.128 0 C-N-CA 125.192 1.397 . . . . 0.0 111.365 -179.15 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 2.0 m -99.09 166.03 13.78 Favored Pre-proline 0 CA--C 1.538 0.483 0 N-CA-C 108.04 -1.096 . . . . 0.0 108.04 178.809 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 24' ' ' PRO . . . . . . . . . . . . . 70.6 Cg_endo -69.16 -28.43 28.15 Favored 'Trans proline' 0 N--CA 1.458 -0.561 0 C-N-CA 121.442 1.428 . . . . 0.0 112.398 -179.72 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 25' ' ' VAL . . . . . . . . . . . . . 96.1 t -67.51 -56.75 12.12 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.31 0 N-CA-C 106.751 -1.574 . . . . 0.0 106.751 179.249 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 1.4 mp0 -56.44 -44.05 80.09 Favored 'General case' 0 CA--C 1.528 0.114 0 C-N-CA 124.92 1.288 . . . . 0.0 111.432 179.53 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 27' ' ' ASP . . . . . 0.424 ' HB2' HG21 ' A' ' 16' ' ' VAL . 30.1 t70 -62.78 -37.53 87.05 Favored 'General case' 0 CA--C 1.517 -0.3 0 N-CA-C 113.131 0.789 . . . . 0.0 113.131 -179.628 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 28' ' ' GLU . . . . . . . . . . . . . 32.3 tt0 -61.62 -50.82 71.0 Favored 'General case' 0 N--CA 1.45 -0.439 0 N-CA-C 107.141 -1.429 . . . . 0.0 107.141 178.963 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 30.3 m -58.83 -59.22 5.78 Favored 'General case' 0 N--CA 1.451 -0.395 0 C-N-CA 124.489 1.116 . . . . 0.0 111.279 -179.473 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 74.9 mt -56.67 -46.12 82.83 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.22 0 C-N-CA 124.45 1.1 . . . . 0.0 110.24 -178.78 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 56.4 ttt180 -62.22 -45.45 93.3 Favored 'General case' 0 CA--C 1.518 -0.279 0 CA-C-N 119.288 0.949 . . . . 0.0 111.255 -179.499 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 4.9 mptp? -60.05 -51.37 69.91 Favored 'General case' 0 CA--C 1.515 -0.397 0 N-CA-C 109.802 -0.444 . . . . 0.0 109.802 -179.059 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 37.2 mmtt -60.27 -52.99 62.92 Favored 'General case' 0 N--CA 1.449 -0.512 0 O-C-N 124.431 1.082 . . . . 0.0 111.022 -179.035 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 34' ' ' ALA . . . . . . . . . . . . . . . -55.94 -54.05 49.42 Favored 'General case' 0 N--CA 1.45 -0.467 0 C-N-CA 123.674 0.79 . . . . 0.0 111.318 -178.818 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 24.6 tt0 -63.16 -42.77 99.47 Favored 'General case' 0 N--CA 1.451 -0.406 0 N-CA-C 112.588 0.588 . . . . 0.0 112.588 -178.094 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 36' ' ' ASP . . . . . . . . . . . . . 26.9 t70 -65.64 -36.9 85.02 Favored 'General case' 0 C--O 1.232 0.143 0 C-N-CA 123.586 0.754 . . . . 0.0 110.502 -179.888 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 37' ' ' SER . . . . . . . . . . . . . 12.4 t -78.83 -7.25 57.7 Favored 'General case' 0 N--CA 1.446 -0.629 0 C-N-CA 123.995 0.918 . . . . 0.0 110.819 179.261 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 70.62 10.34 66.92 Favored Glycine 0 CA--C 1.536 1.346 0 CA-C-N 119.732 1.151 . . . . 0.0 113.28 -179.616 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 39' ' ' LEU . . . . . . . . . . . . . 15.2 mt -108.92 107.56 17.99 Favored 'General case' 0 N--CA 1.451 -0.382 0 N-CA-C 103.961 -2.607 . . . . 0.0 103.961 179.475 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 40' ' ' THR . . . . . . . . . . . . . 13.5 t -46.74 151.66 0.57 Allowed 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 123.808 0.843 . . . . 0.0 109.969 179.582 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 41' ' ' VAL . . . . . . . . . . . . . 58.8 t -43.62 -43.14 1.64 Allowed 'Isoleucine or valine' 0 CA--C 1.527 0.07 0 C-N-CA 125.441 1.496 . . . . 0.0 111.902 -178.109 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 42' ' ' SER . . . . . . . . . . . . . 5.4 p -66.55 -43.64 84.52 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-N 119.588 1.085 . . . . 0.0 112.747 179.458 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.72 -40.76 97.55 Favored 'General case' 0 C--O 1.232 0.137 0 N-CA-C 109.175 -0.676 . . . . 0.0 109.175 178.583 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 44' ' ' TYR . . . . . . . . . . . . . 64.3 t80 -60.6 -53.31 59.04 Favored 'General case' 0 N--CA 1.442 -0.841 0 N-CA-C 107.975 -1.12 . . . . 0.0 107.975 179.146 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 45' ' ' ILE . . . . . . . . . . . . . 19.7 mm -55.04 -54.46 23.85 Favored 'Isoleucine or valine' 0 C--N 1.341 0.231 0 C-N-CA 123.387 0.675 . . . . 0.0 109.285 179.521 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 46' ' ' ARG . . . . . . . . . . . . . 1.1 mtp180 -47.29 -64.59 0.74 Allowed 'General case' 0 C--O 1.22 -0.465 0 C-N-CA 124.138 0.975 . . . . 0.0 109.902 179.43 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 47' ' ' ASN . . . . . . . . . . . . . 27.4 t30 -54.19 -51.15 65.3 Favored 'General case' 0 C--N 1.325 -0.499 0 C-N-CA 126.583 1.953 . . . . 0.0 113.763 -177.944 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -60.39 -29.28 68.84 Favored 'General case' 0 N--CA 1.453 -0.324 0 C-N-CA 122.997 0.519 . . . . 0.0 112.362 -179.062 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 49' ' ' ALA . . . . . . . . . . . . . . . -86.41 -12.42 49.21 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 113.675 0.991 . . . . 0.0 113.675 -179.306 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 11.2 mt -104.86 -29.09 10.73 Favored 'General case' 0 CA--C 1.516 -0.353 0 O-C-N 121.213 -0.929 . . . . 0.0 111.154 -178.932 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 51' ' ' ASN . . . . . . . . . . . . . 74.4 m-80 . . . . . 0 C--O 1.249 1.04 0 C-N-CA 125.337 1.455 . . . . 0.0 111.298 -179.057 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 3.1 t . . . . . 0 N--CA 1.451 -0.391 0 N-CA-C 107.691 -1.226 . . . . 0.0 107.691 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 2.5 t -107.29 145.87 14.18 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.764 0 N-CA-C 106.552 -1.648 . . . . 0.0 106.552 179.142 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 14.5 p -140.69 110.26 3.24 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.765 0 N-CA-C 105.209 -2.145 . . . . 0.0 105.209 178.298 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 21.6 ttt85 -144.72 -175.86 4.83 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 109.348 -0.612 . . . . 0.0 109.348 -178.945 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 13.4 m -119.35 112.43 19.42 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-N 118.82 0.737 . . . . 0.0 110.519 -179.107 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.451 HD21 ' HA ' ' B' ' 42' ' ' SER . 0.0 OUTLIER -105.56 100.74 10.3 Favored 'General case' 0 C--O 1.236 0.344 0 C-N-CA 125.788 1.635 . . . . 0.0 107.64 179.788 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 6.1 mtt180 -84.97 157.46 20.79 Favored 'General case' 0 C--O 1.234 0.239 0 N-CA-C 108.437 -0.949 . . . . 0.0 108.437 177.937 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 92.7 m-85 -140.24 152.54 46.03 Favored 'General case' 0 C--O 1.236 0.359 0 N-CA-C 107.38 -1.341 . . . . 0.0 107.38 179.629 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 1.5 m -83.06 171.59 11.34 Favored Pre-proline 0 CA--C 1.547 0.832 0 CA-C-O 117.772 -1.109 . . . . 0.0 108.233 179.602 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_endo -63.75 -48.44 5.48 Favored 'Trans proline' 0 C--N 1.347 0.497 0 C-N-CA 122.025 1.817 . . . . 0.0 114.713 -177.417 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 93.9 t -64.63 -37.96 81.42 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.337 0 C-N-CA 124.787 1.235 . . . . 0.0 110.375 -179.603 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -64.33 -53.48 48.14 Favored 'General case' 0 N--CA 1.454 -0.264 0 C-N-CA 125.526 1.53 . . . . 0.0 108.043 -179.576 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 3.5 t70 -60.24 -42.91 96.27 Favored 'General case' 0 C--N 1.331 -0.204 0 C-N-CA 127.479 2.312 . . . . 0.0 111.425 179.583 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 88.7 tt0 -63.88 -49.39 72.89 Favored 'General case' 0 N--CA 1.45 -0.434 0 N-CA-C 108.018 -1.105 . . . . 0.0 108.018 179.135 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 91.2 m -58.54 -49.78 76.17 Favored 'General case' 0 CA--C 1.533 0.325 0 N-CA-C 109.169 -0.678 . . . . 0.0 109.169 179.274 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 30' ' ' ILE . . . . . 0.403 HD13 HD11 ' A' ' 45' ' ' ILE . 34.0 mt -58.07 -46.34 88.15 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.303 0 C-N-CA 123.307 0.643 . . . . 0.0 109.38 179.54 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 29.1 ttt180 -60.36 -51.19 70.55 Favored 'General case' 0 CA--C 1.518 -0.284 0 CA-C-N 118.784 0.72 . . . . 0.0 110.839 -179.626 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 1.7 mptm? -61.85 -44.9 95.9 Favored 'General case' 0 CA--C 1.52 -0.21 0 CA-C-O 118.547 -0.74 . . . . 0.0 109.691 -179.092 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 38.4 tptt -64.57 -38.97 92.83 Favored 'General case' 0 C--O 1.224 -0.255 0 CA-C-N 118.905 0.775 . . . . 0.0 110.694 -179.614 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -63.46 -54.67 32.82 Favored 'General case' 0 C--O 1.234 0.263 0 C-N-CA 125.258 1.423 . . . . 0.0 108.578 178.839 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 7.4 tp10 -59.16 -40.05 84.4 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 124.324 1.049 . . . . 0.0 110.48 -179.364 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -71.38 -37.24 71.59 Favored 'General case' 0 CA--C 1.53 0.199 0 C-N-CA 125.751 1.62 . . . . 0.0 111.713 179.704 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 22.7 t -76.67 -15.63 59.75 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 124.441 1.096 . . . . 0.0 111.393 179.784 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 77.54 34.43 39.91 Favored Glycine 0 CA--C 1.53 0.97 0 N-CA-C 110.017 -1.233 . . . . 0.0 110.017 -179.121 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 90.8 mt -136.49 132.69 35.66 Favored 'General case' 0 CA--C 1.514 -0.424 0 N-CA-C 106.735 -1.58 . . . . 0.0 106.735 179.792 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 6.7 t -62.68 150.91 39.77 Favored 'General case' 0 CA--C 1.537 0.471 0 N-CA-C 107.544 -1.28 . . . . 0.0 107.544 178.616 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 41.7 t -47.09 -45.13 8.3 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.446 0 C-N-CA 125.025 1.33 . . . . 0.0 111.513 -179.752 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 56.7 p -56.73 -45.5 81.9 Favored 'General case' 0 CA--C 1.535 0.39 0 CA-C-N 119.029 0.831 . . . . 0.0 111.922 -179.625 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -71.72 -44.33 64.34 Favored 'General case' 0 N--CA 1.449 -0.48 0 C-N-CA 124.369 1.068 . . . . 0.0 109.5 179.104 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 93.2 t80 -52.1 -48.75 64.6 Favored 'General case' 0 CA--C 1.53 0.182 0 C-N-CA 124.519 1.128 . . . . 0.0 109.196 179.79 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 45' ' ' ILE . . . . . 0.508 HG23 HG23 ' B' ' 45' ' ' ILE . 24.2 mm -55.74 -66.61 0.27 Allowed 'Isoleucine or valine' 0 C--O 1.226 -0.143 0 C-N-CA 123.918 0.887 . . . . 0.0 111.411 179.626 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 15.7 ptt180 -58.54 -45.39 89.0 Favored 'General case' 0 C--O 1.219 -0.516 0 CA-C-O 118.398 -0.81 . . . . 0.0 112.001 -177.811 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 16.6 t30 -55.34 -47.72 75.27 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 119.153 0.888 . . . . 0.0 111.451 -179.41 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -67.51 -30.9 70.69 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 122.823 0.449 . . . . 0.0 111.896 179.452 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -77.58 -29.01 51.87 Favored 'General case' 0 N--CA 1.451 -0.418 0 C-N-CA 124.245 1.018 . . . . 0.0 113.432 -179.65 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 8.9 mt -89.23 -39.52 13.47 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 113.279 0.844 . . . . 0.0 113.279 -178.33 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 65.7 m-20 . . . . . 0 C--O 1.251 1.181 0 C-N-CA 123.566 0.746 . . . . 0.0 112.657 -178.446 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 4.3 t . . . . . 0 N--CA 1.449 -0.5 0 N-CA-C 108.059 -1.089 . . . . 0.0 108.059 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 5.8 t -107.18 157.07 7.45 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 N-CA-C 106.34 -1.726 . . . . 0.0 106.34 178.405 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 10.9 p -151.21 120.4 0.87 Allowed 'Isoleucine or valine' 0 N--CA 1.444 -0.76 0 N-CA-C 105.017 -2.216 . . . . 0.0 105.017 178.585 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 4.9 ttt85 -145.96 175.67 10.27 Favored 'General case' 0 C--O 1.238 0.457 0 C-N-CA 119.646 -0.822 . . . . 0.0 111.702 -179.845 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 20.9 m -115.27 76.67 1.01 Allowed 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 106.708 -1.59 . . . . 0.0 106.708 -179.631 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 52.6 tp -89.52 93.16 9.39 Favored 'General case' 0 N--CA 1.448 -0.558 0 C-N-CA 127.362 2.265 . . . . 0.0 107.935 -179.212 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 41.2 mtt180 -76.89 164.56 25.69 Favored 'General case' 0 C--N 1.326 -0.44 0 C-N-CA 123.715 0.806 . . . . 0.0 110.963 -179.728 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 22' ' ' PHE . . . . . . . . . . . . . 69.3 m-85 -142.47 148.56 37.91 Favored 'General case' 0 C--O 1.237 0.395 0 N-CA-C 107.57 -1.27 . . . . 0.0 107.57 179.849 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 49.3 m -79.62 166.12 43.25 Favored Pre-proline 0 CA--C 1.541 0.612 0 N-CA-C 107.771 -1.196 . . . . 0.0 107.771 179.33 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 24' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -64.73 -35.43 46.21 Favored 'Trans proline' 0 C--N 1.348 0.517 0 C-N-CA 121.517 1.478 . . . . 0.0 112.118 -178.696 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 25' ' ' VAL . . . . . . . . . . . . . 89.4 t -60.62 -55.25 25.71 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.375 0 N-CA-C 108.219 -1.03 . . . . 0.0 108.219 179.392 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 4.2 mm-40 -59.92 -44.48 94.3 Favored 'General case' 0 CA--C 1.53 0.206 0 C-N-CA 125.338 1.455 . . . . 0.0 111.109 -178.977 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 27' ' ' ASP . . . . . . . . . . . . . 13.5 t70 -60.97 -46.08 92.17 Favored 'General case' 0 CA--C 1.514 -0.407 0 C-N-CA 125.64 1.576 . . . . 0.0 111.234 179.828 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 28' ' ' GLU . . . . . . . . . . . . . 87.6 tt0 -60.51 -48.18 82.9 Favored 'General case' 0 N--CA 1.448 -0.534 0 N-CA-C 108.387 -0.968 . . . . 0.0 108.387 179.098 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 39.2 m -57.02 -58.08 9.74 Favored 'General case' 0 CA--C 1.536 0.414 0 N-CA-C 109.449 -0.575 . . . . 0.0 109.449 179.522 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 63.4 mt -57.67 -44.02 84.75 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.314 0 C-N-CA 124.456 1.103 . . . . 0.0 111.093 -178.761 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 20.4 ttt180 -61.94 -49.55 75.69 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 119.133 0.879 . . . . 0.0 110.508 179.889 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 1.2 mptm? -62.75 -44.24 96.72 Favored 'General case' 0 CA--C 1.518 -0.252 0 O-C-N 123.463 0.477 . . . . 0.0 110.033 -178.102 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 36.3 tptt -67.94 -43.41 79.16 Favored 'General case' 0 C--O 1.221 -0.436 0 CA-C-O 118.714 -0.66 . . . . 0.0 111.155 -179.584 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 34' ' ' ALA . . . . . . . . . . . . . . . -57.64 -52.29 66.04 Favored 'General case' 0 C--N 1.329 -0.286 0 C-N-CA 124.029 0.932 . . . . 0.0 110.646 179.819 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 31.1 tp10 -63.36 -37.51 87.55 Favored 'General case' 0 CA--C 1.534 0.331 0 N-CA-C 110.46 -0.2 . . . . 0.0 110.46 -178.841 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 36' ' ' ASP . . . . . . . . . . . . . 34.8 t70 -69.28 -41.34 76.98 Favored 'General case' 0 C--O 1.232 0.156 0 C-N-CA 124.419 1.088 . . . . 0.0 111.038 179.741 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 37' ' ' SER . . . . . . . . . . . . . 1.4 t -70.16 -27.17 64.32 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 124.253 1.021 . . . . 0.0 108.886 179.23 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 85.71 22.4 50.26 Favored Glycine 0 CA--C 1.53 1.007 0 N-CA-C 109.959 -1.257 . . . . 0.0 109.959 -178.933 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 39' ' ' LEU . . . . . . . . . . . . . 86.9 mt -122.99 115.0 21.17 Favored 'General case' 0 CA--C 1.508 -0.661 0 N-CA-C 104.034 -2.58 . . . . 0.0 104.034 -179.823 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 40' ' ' THR . . . . . . . . . . . . . 9.0 t -51.9 158.57 1.01 Allowed 'General case' 0 CA--C 1.534 0.345 0 N-CA-C 109.741 -0.466 . . . . 0.0 109.741 179.299 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 41' ' ' VAL . . . . . . . . . . . . . 94.4 t -46.64 -42.11 5.38 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.294 0 C-N-CA 124.201 1.0 . . . . 0.0 112.086 -178.899 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 42' ' ' SER . . . . . 0.451 ' HA ' HD21 ' A' ' 20' ' ' LEU . 19.4 p -64.33 -46.79 81.96 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-N 120.516 1.507 . . . . 0.0 112.109 179.704 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.61 -46.46 85.64 Favored 'General case' 0 C--O 1.222 -0.389 0 C-N-CA 124.23 1.012 . . . . 0.0 108.721 179.119 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 44' ' ' TYR . . . . . . . . . . . . . 82.7 t80 -55.07 -52.98 61.52 Favored 'General case' 0 N--CA 1.447 -0.576 0 C-N-CA 124.399 1.08 . . . . 0.0 109.081 179.426 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 45' ' ' ILE . . . . . 0.508 HG23 HG23 ' A' ' 45' ' ' ILE . 11.0 mm -55.89 -62.25 0.89 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.25 0 C-N-CA 124.688 1.195 . . . . 0.0 111.504 179.781 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 46' ' ' ARG . . . . . . . . . . . . . 22.4 ptt180 -58.67 -39.27 80.15 Favored 'General case' 0 N--CA 1.454 -0.262 0 CA-C-O 117.809 -1.091 . . . . 0.0 112.847 -177.69 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 47' ' ' ASN . . . . . . . . . . . . . 29.2 t30 -65.12 -56.01 15.44 Favored 'General case' 0 C--N 1.332 -0.162 0 C-N-CA 124.255 1.022 . . . . 0.0 109.409 179.212 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -56.9 -29.27 62.86 Favored 'General case' 0 N--CA 1.454 -0.274 0 C-N-CA 124.453 1.101 . . . . 0.0 112.055 -179.385 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 49' ' ' ALA . . . . . . . . . . . . . . . -75.08 -25.6 58.69 Favored 'General case' 0 N--CA 1.445 -0.714 0 N-CA-C 113.748 1.018 . . . . 0.0 113.748 179.982 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 10.7 mt -93.72 -44.79 7.98 Favored 'General case' 0 C--O 1.238 0.461 0 C-N-CA 123.373 0.669 . . . . 0.0 109.226 -179.847 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 51' ' ' ASN . . . . . . . . . . . . . 73.0 m-20 . . . . . 0 C--O 1.251 1.132 0 C-N-CA 125.558 1.543 . . . . 0.0 109.99 -179.751 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 2.8 t . . . . . 0 N--CA 1.446 -0.673 0 N-CA-C 108.253 -1.017 . . . . 0.0 108.253 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 16' ' ' VAL . . . . . 0.407 HG21 ' HB2' ' B' ' 27' ' ' ASP . 6.2 t -132.48 148.74 31.78 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.657 0 N-CA-C 105.65 -1.982 . . . . 0.0 105.65 178.963 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 14.8 p -139.1 112.96 6.92 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.038 0 N-CA-C 105.815 -1.92 . . . . 0.0 105.815 178.02 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 17.7 ttt180 -140.93 178.81 7.1 Favored 'General case' 0 C--O 1.236 0.388 0 N-CA-C 107.549 -1.278 . . . . 0.0 107.549 -179.635 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 6.4 m -116.77 108.03 15.38 Favored 'General case' 0 C--O 1.237 0.414 0 N-CA-C 106.91 -1.515 . . . . 0.0 106.91 179.765 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.412 HD12 ' CZ ' ' A' ' 22' ' ' PHE . 0.0 OUTLIER -96.49 99.77 11.41 Favored 'General case' 0 C--O 1.235 0.308 0 N-CA-C 108.435 -0.95 . . . . 0.0 108.435 -178.94 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 1.2 mmt-85 -81.65 154.9 25.88 Favored 'General case' 0 C--O 1.235 0.316 0 C-N-CA 123.36 0.664 . . . . 0.0 109.484 179.094 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 22' ' ' PHE . . . . . 0.412 ' CZ ' HD12 ' A' ' 20' ' ' LEU . 96.9 m-85 -148.05 152.84 38.07 Favored 'General case' 0 CA--C 1.516 -0.344 0 C-N-CA 124.206 1.002 . . . . 0.0 108.644 178.633 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 14.5 m -79.49 167.04 37.25 Favored Pre-proline 0 CA--C 1.545 0.76 0 N-CA-C 107.496 -1.298 . . . . 0.0 107.496 178.603 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 34.5 Cg_endo -63.38 -43.01 19.41 Favored 'Trans proline' 0 N--CA 1.461 -0.418 0 C-N-CA 121.515 1.477 . . . . 0.0 112.025 -178.713 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 60.7 t -66.49 -39.36 83.81 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.557 0 C-N-CA 124.198 0.999 . . . . 0.0 109.921 179.795 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 97.5 mt-10 -63.7 -41.45 98.12 Favored 'General case' 0 N--CA 1.465 0.279 0 O-C-N 121.209 -0.932 . . . . 0.0 109.731 179.707 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 27' ' ' ASP . . . . . 0.502 ' HB2' HG21 ' B' ' 16' ' ' VAL . 27.1 t70 -68.19 -47.51 67.74 Favored 'General case' 0 C--O 1.218 -0.595 0 C-N-CA 124.445 1.098 . . . . 0.0 110.719 179.442 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -58.01 -34.26 69.83 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 118.692 0.678 . . . . 0.0 109.268 178.794 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 39.5 m -70.88 -60.71 2.09 Favored 'General case' 0 N--CA 1.45 -0.433 0 O-C-N 121.795 -0.566 . . . . 0.0 109.614 179.309 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 51.0 mt -58.73 -42.6 85.74 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.295 0 C-N-CA 123.765 0.826 . . . . 0.0 111.814 -178.247 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 59.7 ttt180 -64.27 -44.83 90.5 Favored 'General case' 0 N--CA 1.448 -0.538 0 CA-C-O 117.336 -1.316 . . . . 0.0 110.539 -179.481 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 2.1 mptp? -68.03 -44.73 75.8 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-N 119.863 1.211 . . . . 0.0 109.282 179.536 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 37.0 mmtt -55.93 -49.17 74.24 Favored 'General case' 0 CA--C 1.518 -0.253 0 C-N-CA 123.686 0.795 . . . . 0.0 110.609 -179.779 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -59.41 -53.8 54.05 Favored 'General case' 0 N--CA 1.444 -0.76 0 C-N-CA 125.419 1.487 . . . . 0.0 110.264 179.897 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 25.7 tt0 -57.76 -41.26 81.58 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 123.761 0.824 . . . . 0.0 110.805 -179.498 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 29.2 t70 -68.34 -40.24 81.61 Favored 'General case' 0 N--CA 1.463 0.201 0 C-N-CA 125.452 1.501 . . . . 0.0 109.95 179.663 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 22.5 t -73.06 -15.39 61.51 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 123.817 0.847 . . . . 0.0 109.647 178.356 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 75.21 0.82 62.34 Favored Glycine 0 CA--C 1.533 1.207 0 O-C-N 120.817 -1.177 . . . . 0.0 110.161 -178.189 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 40.7 mt -96.53 114.41 26.07 Favored 'General case' 0 N--CA 1.449 -0.49 0 N-CA-C 104.713 -2.329 . . . . 0.0 104.713 179.543 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 4.3 t -51.66 153.78 2.23 Favored 'General case' 0 CA--C 1.539 0.531 0 N-CA-C 109.475 -0.565 . . . . 0.0 109.475 179.336 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 55.8 t -44.88 -42.79 2.48 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.124 0 C-N-CA 124.964 1.306 . . . . 0.0 112.205 -178.805 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 1.6 p -63.22 -45.54 91.17 Favored 'General case' 0 CA--C 1.536 0.416 0 CA-C-N 119.034 0.834 . . . . 0.0 112.032 179.859 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -65.97 -45.37 81.93 Favored 'General case' 0 C--O 1.222 -0.38 0 C-N-CA 123.7 0.8 . . . . 0.0 109.083 178.777 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 65.1 t80 -56.07 -52.04 65.69 Favored 'General case' 0 N--CA 1.452 -0.361 0 C-N-CA 124.702 1.201 . . . . 0.0 109.11 179.888 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 3.9 mm -54.79 -62.66 0.7 Allowed 'Isoleucine or valine' 0 N--CA 1.457 -0.087 0 C-N-CA 124.91 1.284 . . . . 0.0 110.588 179.782 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 14.5 ptt180 -58.36 -46.66 85.87 Favored 'General case' 0 C--O 1.222 -0.369 0 CA-C-O 118.311 -0.852 . . . . 0.0 111.368 -178.195 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 22.0 t30 -56.66 -54.57 44.52 Favored 'General case' 0 C--O 1.225 -0.205 0 CA-C-N 119.181 0.901 . . . . 0.0 110.251 -179.748 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -60.25 -33.78 72.78 Favored 'General case' 0 N--CA 1.452 -0.337 0 N-CA-C 112.409 0.522 . . . . 0.0 112.409 -179.45 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -72.24 -40.89 67.39 Favored 'General case' 0 C--O 1.232 0.182 0 N-CA-C 113.049 0.759 . . . . 0.0 113.049 -179.154 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 14.7 mt -85.04 -37.03 20.83 Favored 'General case' 0 C--N 1.331 -0.232 0 C-N-CA 124.334 1.054 . . . . 0.0 113.295 -177.938 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 72.6 m-80 . . . . . 0 C--O 1.259 1.595 0 N-CA-C 113.684 0.994 . . . . 0.0 113.684 -177.095 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 10.5 t . . . . . 0 N--CA 1.449 -0.486 0 N-CA-C 108.302 -0.999 . . . . 0.0 108.302 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' B' B ' 16' ' ' VAL . . . . . 0.502 HG21 ' HB2' ' A' ' 27' ' ' ASP . 5.6 t -125.43 145.62 32.49 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.588 0 N-CA-C 106.518 -1.66 . . . . 0.0 106.518 179.575 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 9.4 p -137.82 119.1 17.43 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.365 0 N-CA-C 108.46 -0.941 . . . . 0.0 108.46 -179.932 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 17.8 ttt180 -149.43 157.9 43.7 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-O 120.519 0.2 . . . . 0.0 110.814 179.073 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 1.6 m -94.96 93.84 7.65 Favored 'General case' 0 N--CA 1.451 -0.413 0 C-N-CA 125.28 1.432 . . . . 0.0 107.917 179.934 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -95.49 94.8 8.0 Favored 'General case' 0 C--N 1.327 -0.409 0 C-N-CA 124.574 1.15 . . . . 0.0 108.869 -179.654 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 20.5 mmm-85 -76.47 147.68 37.71 Favored 'General case' 0 C--O 1.239 0.514 0 N-CA-C 108.799 -0.815 . . . . 0.0 108.799 179.273 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 22' ' ' PHE . . . . . . . . . . . . . 92.3 m-85 -136.0 153.46 51.37 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 124.674 1.19 . . . . 0.0 108.796 179.541 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 18.7 m -82.04 168.7 22.09 Favored Pre-proline 0 CA--C 1.541 0.614 0 C-N-CA 124.313 1.045 . . . . 0.0 109.74 179.232 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 24' ' ' PRO . . . . . . . . . . . . . 33.0 Cg_endo -64.36 -36.58 44.27 Favored 'Trans proline' 0 C--N 1.349 0.582 0 C-N-CA 121.658 1.572 . . . . 0.0 111.205 -179.391 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 25' ' ' VAL . . . . . . . . . . . . . 86.0 t -66.34 -45.54 89.27 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.211 0 N-CA-C 108.35 -0.981 . . . . 0.0 108.35 179.02 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 96.7 mt-10 -60.9 -49.58 76.88 Favored 'General case' 0 N--CA 1.455 -0.21 0 C-N-CA 123.62 0.768 . . . . 0.0 110.856 -179.319 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 27' ' ' ASP . . . . . 0.407 ' HB2' HG21 ' A' ' 16' ' ' VAL . 33.6 t70 -60.31 -53.27 59.65 Favored 'General case' 0 CA--C 1.502 -0.871 0 CA-C-O 117.401 -1.285 . . . . 0.0 111.751 -179.365 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 28' ' ' GLU . . . . . . . . . . . . . 24.2 mm-40 -57.53 -44.37 85.06 Favored 'General case' 0 N--CA 1.454 -0.258 0 CA-C-N 118.855 0.752 . . . . 0.0 109.012 -179.442 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 30.6 m -58.15 -53.05 62.65 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-N 118.536 0.607 . . . . 0.0 110.45 179.966 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 57.7 mt -61.74 -44.48 98.83 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.269 0 C-N-CA 124.323 1.049 . . . . 0.0 110.831 -179.414 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 24.7 ttt180 -62.62 -46.34 88.7 Favored 'General case' 0 C--N 1.325 -0.486 0 C-N-CA 126.204 1.801 . . . . 0.0 111.32 -178.902 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 4.7 mptp? -66.78 -42.84 85.41 Favored 'General case' 0 CA--C 1.518 -0.253 0 N-CA-C 108.9 -0.778 . . . . 0.0 108.9 -179.561 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 39.3 mmtt -63.15 -53.34 54.91 Favored 'General case' 0 C--O 1.222 -0.389 0 C-N-CA 123.496 0.718 . . . . 0.0 109.93 179.219 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 34' ' ' ALA . . . . . . . . . . . . . . . -52.51 -50.6 62.47 Favored 'General case' 0 C--O 1.236 0.359 0 C-N-CA 124.836 1.254 . . . . 0.0 111.394 -178.826 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -63.76 -39.95 95.51 Favored 'General case' 0 CA--C 1.532 0.258 0 CA-C-O 119.195 -0.431 . . . . 0.0 111.822 -179.573 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 36' ' ' ASP . . . . . . . . . . . . . 37.6 t70 -75.08 -30.73 61.02 Favored 'General case' 0 N--CA 1.465 0.317 0 C-N-CA 123.959 0.904 . . . . 0.0 112.931 -178.285 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 37' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -86.99 -6.13 58.86 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-O 118.156 -0.926 . . . . 0.0 112.459 -179.488 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 75.89 14.35 82.26 Favored Glycine 0 CA--C 1.534 1.262 0 CA-C-N 119.87 1.214 . . . . 0.0 114.172 179.348 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 39' ' ' LEU . . . . . . . . . . . . . 20.9 mt -121.68 112.27 18.22 Favored 'General case' 0 CA--C 1.517 -0.316 0 N-CA-C 105.828 -1.916 . . . . 0.0 105.828 179.623 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 40' ' ' THR . . . . . . . . . . . . . 14.1 t -52.05 156.11 1.67 Allowed 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 124.702 1.201 . . . . 0.0 109.561 179.163 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 41' ' ' VAL . . . . . . . . . . . . . 78.2 t -44.62 -47.39 2.61 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.232 0 C-N-CA 125.216 1.406 . . . . 0.0 112.566 -177.951 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 42' ' ' SER . . . . . . . . . . . . . 14.1 m -63.15 -47.45 82.63 Favored 'General case' 0 CA--C 1.543 0.696 0 CA-C-N 118.792 0.724 . . . . 0.0 111.523 -179.432 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -65.04 -43.3 92.84 Favored 'General case' 0 C--O 1.22 -0.476 0 C-N-CA 124.475 1.11 . . . . 0.0 109.788 178.644 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 44' ' ' TYR . . . . . . . . . . . . . 80.8 t80 -53.79 -53.72 48.35 Favored 'General case' 0 N--CA 1.455 -0.183 0 C-N-CA 125.515 1.526 . . . . 0.0 108.551 179.447 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 45' ' ' ILE . . . . . . . . . . . . . 18.5 mm -54.7 -61.21 1.07 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.226 0 C-N-CA 123.948 0.899 . . . . 0.0 111.202 179.595 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 46' ' ' ARG . . . . . . . . . . . . . 29.0 ptt180 -57.7 -45.23 85.98 Favored 'General case' 0 N--CA 1.466 0.374 0 O-C-N 121.975 -0.453 . . . . 0.0 111.345 -178.324 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 47' ' ' ASN . . . . . . . . . . . . . 35.2 t30 -57.91 -55.63 32.39 Favored 'General case' 0 N--CA 1.449 -0.504 0 C-N-CA 123.697 0.799 . . . . 0.0 111.436 -179.389 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -62.29 -32.01 72.68 Favored 'General case' 0 CA--C 1.529 0.171 0 C-N-CA 124.313 1.045 . . . . 0.0 112.385 -179.656 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 49' ' ' ALA . . . . . . . . . . . . . . . -77.14 -40.91 43.88 Favored 'General case' 0 N--CA 1.451 -0.394 0 N-CA-C 113.195 0.813 . . . . 0.0 113.195 -178.75 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 22.8 mt -74.18 -43.18 58.28 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 118.467 0.576 . . . . 0.0 111.685 -178.919 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 51' ' ' ASN . . . . . . . . . . . . . 53.3 m-80 . . . . . 0 C--O 1.254 1.326 0 CA-C-O 117.951 -1.023 . . . . 0.0 110.927 -179.785 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 4.8 t . . . . . 0 N--CA 1.447 -0.62 0 N-CA-C 109.333 -0.618 . . . . 0.0 109.333 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 9.3 t -109.96 84.5 0.73 Allowed 'Isoleucine or valine' 0 CA--C 1.513 -0.448 0 N-CA-C 109.765 -0.457 . . . . 0.0 109.765 -179.663 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 11.8 p -83.24 121.01 35.55 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.498 0 N-CA-C 105.502 -2.036 . . . . 0.0 105.502 178.107 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 13.0 ttt85 -157.07 163.21 39.26 Favored 'General case' 0 C--O 1.236 0.39 0 N-CA-C 107.79 -1.189 . . . . 0.0 107.79 179.042 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 2.2 m -102.14 130.71 48.84 Favored 'General case' 0 C--N 1.327 -0.413 0 N-CA-C 106.716 -1.587 . . . . 0.0 106.716 179.698 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -130.43 125.87 35.55 Favored 'General case' 0 N--CA 1.448 -0.533 0 N-CA-C 107.005 -1.48 . . . . 0.0 107.005 179.171 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 15.2 mtp180 -107.21 155.55 19.79 Favored 'General case' 0 N--CA 1.455 -0.219 0 C-N-CA 124.306 1.042 . . . . 0.0 111.136 179.666 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 35.5 m-85 -133.73 -171.41 2.71 Favored 'General case' 0 C--O 1.236 0.365 0 C-N-CA 125.567 1.547 . . . . 0.0 108.512 179.787 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 1.2 m -118.18 175.75 1.95 Allowed Pre-proline 0 CA--C 1.539 0.542 0 CA-C-O 117.218 -1.373 . . . . 0.0 107.668 179.433 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_endo -65.0 -51.06 1.77 Allowed 'Trans proline' 0 N--CA 1.458 -0.574 0 CA-C-N 121.458 1.556 . . . . 0.0 111.869 -178.368 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 57.9 t -59.46 -44.3 92.48 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.268 0 C-N-CA 124.713 1.205 . . . . 0.0 111.002 -179.823 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 3.9 mm-40 -65.8 -48.19 72.57 Favored 'General case' 0 C--N 1.331 -0.201 0 C-N-CA 123.852 0.861 . . . . 0.0 110.351 -178.572 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 7.6 t70 -61.42 -43.5 98.77 Favored 'General case' 0 CA--C 1.514 -0.431 0 C-N-CA 124.176 0.99 . . . . 0.0 110.865 179.641 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 45.6 tt0 -61.85 -48.76 79.1 Favored 'General case' 0 N--CA 1.448 -0.554 0 C-N-CA 125.035 1.334 . . . . 0.0 108.568 179.697 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 79.8 m -56.79 -51.72 67.83 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 123.378 0.671 . . . . 0.0 109.222 179.185 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 82.3 mt -62.86 -41.66 93.46 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.41 0 C-N-CA 123.592 0.757 . . . . 0.0 110.296 -179.372 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 14.9 ttt180 -62.44 -52.22 64.39 Favored 'General case' 0 CA--C 1.517 -0.291 0 O-C-N 121.042 -1.036 . . . . 0.0 110.083 -179.928 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 5.0 mptp? -57.69 -47.85 81.2 Favored 'General case' 0 N--CA 1.452 -0.33 0 CA-C-O 118.626 -0.702 . . . . 0.0 109.348 -179.113 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 50.4 mttp -68.46 -35.12 77.11 Favored 'General case' 0 C--O 1.223 -0.29 0 CA-C-O 117.871 -1.061 . . . . 0.0 111.952 -179.173 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -60.81 -52.44 65.08 Favored 'General case' 0 C--N 1.332 -0.162 0 N-CA-C 106.845 -1.539 . . . . 0.0 106.845 177.844 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 8.5 tt0 -62.39 -38.96 91.64 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-N 115.856 -0.611 . . . . 0.0 111.728 -179.389 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 49.6 t0 -66.02 -42.68 89.31 Favored 'General case' 0 N--CA 1.466 0.355 0 N-CA-C 107.959 -1.126 . . . . 0.0 107.959 179.022 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 20.8 t -61.6 -33.27 73.62 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 125.488 1.515 . . . . 0.0 108.102 178.885 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 91.27 38.23 6.02 Favored Glycine 0 N--CA 1.447 -0.583 0 N-CA-C 107.776 -2.13 . . . . 0.0 107.776 -179.032 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 69.1 mt -138.56 159.31 42.42 Favored 'General case' 0 N--CA 1.447 -0.592 0 C-N-CA 126.596 1.958 . . . . 0.0 108.92 -179.17 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 1.7 t -82.37 154.81 25.05 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 104.698 -2.334 . . . . 0.0 104.698 176.906 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 37.4 t -44.93 -42.78 2.51 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.428 0 C-N-CA 126.466 1.907 . . . . 0.0 110.598 178.796 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 6.7 p -58.74 -51.86 68.17 Favored 'General case' 0 CA--C 1.531 0.244 0 CA-C-N 119.66 1.118 . . . . 0.0 111.644 179.52 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -61.15 -47.78 84.64 Favored 'General case' 0 N--CA 1.455 -0.196 0 C-N-CA 124.728 1.211 . . . . 0.0 109.731 179.195 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 77.3 t80 -55.32 -47.17 76.05 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 124.369 1.068 . . . . 0.0 109.5 179.581 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 3.0 mm -57.42 -66.53 0.32 Allowed 'Isoleucine or valine' 0 C--O 1.225 -0.225 0 C-N-CA 125.267 1.427 . . . . 0.0 110.03 179.327 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 9.2 ptm180 -54.37 -40.98 68.64 Favored 'General case' 0 C--O 1.22 -0.472 0 CA-C-O 118.001 -1.0 . . . . 0.0 112.914 -178.501 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 34.9 t30 -68.97 -45.12 71.47 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 119.642 1.11 . . . . 0.0 112.4 -179.339 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -64.76 -33.4 75.9 Favored 'General case' 0 C--O 1.224 -0.288 0 CA-C-N 118.468 0.576 . . . . 0.0 109.943 178.869 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -72.84 -14.25 61.46 Favored 'General case' 0 N--CA 1.453 -0.305 0 C-N-CA 124.199 0.999 . . . . 0.0 112.99 -179.375 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 20.7 mt -100.47 -40.88 7.23 Favored 'General case' 0 CA--C 1.509 -0.626 0 CA-C-O 118.277 -0.868 . . . . 0.0 109.9 178.826 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 70.0 m-80 . . . . . 0 C--O 1.251 1.178 0 O-C-N 124.455 1.097 . . . . 0.0 110.687 179.519 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 10.9 t . . . . . 0 N--CA 1.45 -0.458 0 N-CA-C 108.435 -0.95 . . . . 0.0 108.435 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 2.8 t -136.12 88.9 0.75 Allowed 'Isoleucine or valine' 0 N--CA 1.447 -0.594 0 N-CA-C 106.948 -1.501 . . . . 0.0 106.948 -179.593 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 8.3 p -85.5 103.7 12.68 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.447 0 N-CA-C 104.751 -2.314 . . . . 0.0 104.751 178.689 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 36.1 ttt85 -137.66 165.57 26.06 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 108.376 -0.972 . . . . 0.0 108.376 -179.669 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 35.1 m -112.67 120.66 42.31 Favored 'General case' 0 N--CA 1.449 -0.483 0 N-CA-C 105.275 -2.12 . . . . 0.0 105.275 179.696 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -118.75 111.71 18.82 Favored 'General case' 0 CA--C 1.517 -0.317 0 C-N-CA 123.699 0.799 . . . . 0.0 109.686 -178.242 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 62.0 mtm180 -90.08 153.91 20.19 Favored 'General case' 0 N--CA 1.454 -0.259 0 CA-C-O 121.225 0.536 . . . . 0.0 111.283 179.362 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 22' ' ' PHE . . . . . . . . . . . . . 63.9 m-85 -139.33 162.36 35.19 Favored 'General case' 0 C--O 1.235 0.298 0 C-N-CA 126.833 2.053 . . . . 0.0 107.256 -179.588 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -94.86 177.82 1.7 Allowed Pre-proline 0 CA--C 1.546 0.824 0 N-CA-C 108.463 -0.939 . . . . 0.0 108.463 179.069 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 24' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -71.32 -23.47 24.03 Favored 'Trans proline' 0 N--CA 1.461 -0.402 0 C-N-CA 121.583 1.522 . . . . 0.0 114.458 -177.843 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 25' ' ' VAL . . . . . . . . . . . . . 98.6 t -75.35 -45.7 39.93 Favored 'Isoleucine or valine' 0 C--O 1.235 0.327 0 N-CA-C 107.608 -1.256 . . . . 0.0 107.608 179.823 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -63.67 -40.81 97.77 Favored 'General case' 0 N--CA 1.451 -0.419 0 CA-C-O 119.207 -0.425 . . . . 0.0 110.398 179.22 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 27' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -62.43 -48.08 81.23 Favored 'General case' 0 CA--C 1.51 -0.564 0 C-N-CA 123.289 0.635 . . . . 0.0 111.494 -179.702 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 28' ' ' GLU . . . . . . . . . . . . . 29.3 tt0 -60.34 -49.28 78.22 Favored 'General case' 0 N--CA 1.449 -0.524 0 N-CA-C 108.679 -0.859 . . . . 0.0 108.679 179.15 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 49.6 m -58.23 -57.21 13.89 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 122.701 0.4 . . . . 0.0 110.131 -179.818 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 55.4 mt -56.5 -47.23 82.12 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.272 0 C-N-CA 124.08 0.952 . . . . 0.0 110.888 -179.253 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 23.3 ttt-85 -62.23 -44.57 96.27 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 118.378 -0.82 . . . . 0.0 111.367 -178.922 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 1.7 mptm? -61.9 -50.89 70.37 Favored 'General case' 0 C--O 1.226 -0.167 0 CA-C-N 118.618 0.644 . . . . 0.0 109.406 179.4 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 4.6 mptp? -62.53 -42.69 99.69 Favored 'General case' 0 N--CA 1.466 0.354 0 C-N-CA 123.193 0.597 . . . . 0.0 111.57 -179.023 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 34' ' ' ALA . . . . . . . . . . . . . . . -58.6 -53.06 62.59 Favored 'General case' 0 N--CA 1.451 -0.405 0 C-N-CA 123.645 0.778 . . . . 0.0 109.521 179.436 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 14.1 tt0 -62.35 -39.97 94.86 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-O 118.689 -0.672 . . . . 0.0 111.335 -178.037 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 36' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -60.59 -46.57 89.75 Favored 'General case' 0 CA--C 1.516 -0.34 0 C-N-CA 126.385 1.874 . . . . 0.0 108.33 179.099 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 37' ' ' SER . . . . . . . . . . . . . 6.3 t -73.22 -14.35 61.32 Favored 'General case' 0 N--CA 1.451 -0.399 0 C-N-CA 120.935 -0.306 . . . . 0.0 110.934 -179.686 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 81.92 2.97 90.71 Favored Glycine 0 CA--C 1.528 0.9 0 CA-C-O 118.713 -1.048 . . . . 0.0 111.71 -179.479 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 39' ' ' LEU . . . . . . . . . . . . . 64.0 mt -100.2 123.36 44.33 Favored 'General case' 0 N--CA 1.445 -0.698 0 C-N-CA 127.627 2.371 . . . . 0.0 106.269 -179.4 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 40' ' ' THR . . . . . . . . . . . . . 11.7 t -54.38 153.63 5.3 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 108.791 -0.818 . . . . 0.0 108.791 178.753 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 41' ' ' VAL . . . . . . . . . . . . . 56.1 t -47.6 -43.35 9.25 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.326 0 C-N-CA 124.768 1.227 . . . . 0.0 111.874 -179.21 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 42' ' ' SER . . . . . . . . . . . . . 2.1 p -61.26 -44.95 96.41 Favored 'General case' 0 CA--C 1.535 0.366 0 O-C-N 121.499 -0.751 . . . . 0.0 111.392 179.397 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -65.63 -44.29 86.89 Favored 'General case' 0 C--O 1.224 -0.271 0 C-N-CA 123.587 0.755 . . . . 0.0 108.98 178.692 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 44' ' ' TYR . . . . . . . . . . . . . 64.2 t80 -53.79 -50.5 65.95 Favored 'General case' 0 N--CA 1.454 -0.262 0 C-N-CA 124.654 1.182 . . . . 0.0 109.955 179.684 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 45' ' ' ILE . . . . . . . . . . . . . 10.0 mm -55.41 -62.48 0.79 Allowed 'Isoleucine or valine' 0 N--CA 1.463 0.196 0 C-N-CA 123.984 0.914 . . . . 0.0 111.41 179.853 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 46' ' ' ARG . . . . . . . . . . . . . 7.3 ptm180 -56.89 -40.64 76.61 Favored 'General case' 0 C--O 1.223 -0.342 0 CA-C-O 119.041 -0.504 . . . . 0.0 111.03 -179.045 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 47' ' ' ASN . . . . . . . . . . . . . 24.3 t30 -60.75 -55.38 33.89 Favored 'General case' 0 N--CA 1.449 -0.51 0 C-N-CA 123.677 0.791 . . . . 0.0 110.417 -179.583 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -61.46 -31.23 71.18 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 123.783 0.833 . . . . 0.0 112.382 -179.659 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 49' ' ' ALA . . . . . . . . . . . . . . . -75.27 -21.17 58.73 Favored 'General case' 0 N--CA 1.447 -0.595 0 N-CA-C 113.807 1.04 . . . . 0.0 113.807 -179.322 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 20.8 mt -101.12 -36.09 9.09 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-N 118.577 0.626 . . . . 0.0 110.468 -179.883 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 51' ' ' ASN . . . . . . . . . . . . . 58.0 m-80 . . . . . 0 C--O 1.246 0.898 0 CA-C-O 117.319 -1.324 . . . . 0.0 110.103 179.88 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 3.4 t . . . . . 0 N--CA 1.44 -0.925 0 CA-C-O 123.342 1.544 . . . . 0.0 109.153 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 3.1 t -142.08 143.37 26.67 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.881 0 N-CA-C 102.993 -2.966 . . . . 0.0 102.993 178.328 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 8.6 p -139.04 119.73 15.25 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.064 0 N-CA-C 106.409 -1.7 . . . . 0.0 106.409 178.77 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 52.6 ttm-85 -139.08 158.31 44.41 Favored 'General case' 0 CA--C 1.51 -0.568 0 CA-C-N 114.773 -1.103 . . . . 0.0 109.3 179.487 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 19.6 m -104.74 97.43 7.32 Favored 'General case' 0 N--CA 1.445 -0.68 0 N-CA-C 100.379 -3.934 . . . . 0.0 100.379 178.05 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 53.3 tp -109.9 92.29 3.99 Favored 'General case' 0 N--CA 1.448 -0.532 0 C-N-CA 125.964 1.706 . . . . 0.0 111.537 -178.038 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.414 ' HA ' ' O ' ' B' ' 16' ' ' VAL . 8.3 mpt_? -66.78 156.08 36.47 Favored 'General case' 0 N--CA 1.44 -0.966 0 C-N-CA 123.94 0.896 . . . . 0.0 110.151 177.054 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 62.7 m-85 -131.48 147.53 52.56 Favored 'General case' 0 N--CA 1.466 0.355 0 N-CA-C 104.125 -2.546 . . . . 0.0 104.125 177.25 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 1.1 m -76.83 169.52 20.74 Favored Pre-proline 0 CA--C 1.545 0.757 0 N-CA-C 109.07 -0.715 . . . . 0.0 109.07 -179.004 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 59.5 Cg_endo -67.17 -32.25 34.27 Favored 'Trans proline' 0 C--N 1.345 0.377 0 C-N-CA 121.946 1.764 . . . . 0.0 113.584 -178.562 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 55.9 t -74.29 -49.31 32.83 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.174 0 N-CA-C 107.471 -1.307 . . . . 0.0 107.471 179.228 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 2.4 mp0 -56.24 -46.07 79.74 Favored 'General case' 0 N--CA 1.449 -0.514 0 C-N-CA 124.825 1.25 . . . . 0.0 108.976 179.578 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -62.26 -48.05 81.64 Favored 'General case' 0 CA--C 1.512 -0.51 0 C-N-CA 123.874 0.87 . . . . 0.0 111.999 179.58 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 39.7 tt0 -59.2 -48.4 81.75 Favored 'General case' 0 N--CA 1.452 -0.35 0 N-CA-C 108.896 -0.779 . . . . 0.0 108.896 -179.888 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 51.9 m -59.04 -55.18 38.45 Favored 'General case' 0 N--CA 1.455 -0.206 0 C-N-CA 123.585 0.754 . . . . 0.0 109.213 179.377 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 90.3 mt -58.5 -41.53 82.02 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.245 0 C-N-CA 123.327 0.651 . . . . 0.0 110.366 -179.176 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 54.5 ttt180 -60.62 -49.9 75.69 Favored 'General case' 0 N--CA 1.462 0.15 0 CA-C-N 119.301 0.955 . . . . 0.0 108.981 179.038 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 5.2 mptp? -58.16 -53.02 62.99 Favored 'General case' 0 C--O 1.225 -0.206 0 N-CA-C 109.077 -0.712 . . . . 0.0 109.077 179.578 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -59.99 -43.19 95.31 Favored 'General case' 0 CA--C 1.517 -0.304 0 C-N-CA 123.342 0.657 . . . . 0.0 112.173 -178.64 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -63.76 -48.63 76.17 Favored 'General case' 0 N--CA 1.446 -0.635 0 C-N-CA 124.441 1.096 . . . . 0.0 110.244 -179.787 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 27.7 tt0 -67.06 -32.92 74.43 Favored 'General case' 0 CA--C 1.533 0.297 0 O-C-N 121.364 -0.835 . . . . 0.0 110.877 179.891 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 8.1 t70 -70.17 -44.79 68.03 Favored 'General case' 0 CA--C 1.514 -0.437 0 C-N-CA 124.334 1.054 . . . . 0.0 108.857 -178.986 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 22.7 t -75.63 -9.8 58.9 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 124.78 1.232 . . . . 0.0 110.324 178.678 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 74.14 -6.89 18.91 Favored Glycine 0 CA--C 1.532 1.153 0 CA-C-O 118.845 -0.975 . . . . 0.0 111.014 -178.632 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 44.1 mt -88.41 119.17 28.59 Favored 'General case' 0 CA--C 1.513 -0.479 0 CA-C-N 119.89 1.845 . . . . 0.0 107.316 -179.429 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 5.2 t -48.37 151.36 1.08 Allowed 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 124.396 1.078 . . . . 0.0 109.768 178.884 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 41.6 t -46.72 -45.26 7.27 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.315 0 C-N-CA 125.018 1.327 . . . . 0.0 111.447 -178.762 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 54.3 m -61.2 -47.45 86.07 Favored 'General case' 0 CA--C 1.539 0.55 0 O-C-N 121.453 -0.78 . . . . 0.0 111.644 179.705 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -64.96 -44.16 90.29 Favored 'General case' 0 C--O 1.223 -0.317 0 C-N-CA 123.828 0.851 . . . . 0.0 109.36 178.787 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 80.8 t80 -55.12 -51.27 66.96 Favored 'General case' 0 N--CA 1.45 -0.471 0 C-N-CA 124.899 1.28 . . . . 0.0 109.837 179.725 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 12.1 mm -55.56 -65.86 0.33 Allowed 'Isoleucine or valine' 0 C--N 1.339 0.132 0 C-N-CA 124.897 1.279 . . . . 0.0 110.416 179.734 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 11.5 ptt180 -55.6 -44.94 77.45 Favored 'General case' 0 C--O 1.22 -0.452 0 CA-C-O 117.894 -1.05 . . . . 0.0 111.843 -178.241 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 30.8 t30 -58.35 -52.1 67.03 Favored 'General case' 0 CA--C 1.529 0.148 0 CA-C-N 119.322 0.964 . . . . 0.0 110.133 179.653 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -61.29 -30.84 70.73 Favored 'General case' 0 CA--C 1.533 0.316 0 N-CA-C 112.246 0.462 . . . . 0.0 112.246 179.749 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -82.37 -32.2 29.37 Favored 'General case' 0 C--O 1.222 -0.355 0 N-CA-C 114.817 1.414 . . . . 0.0 114.817 -178.969 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 22.1 mt -81.8 -41.58 20.92 Favored 'General case' 0 CA--C 1.508 -0.667 0 N-CA-C 113.944 1.09 . . . . 0.0 113.944 -177.551 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 69.5 m-80 . . . . . 0 C--O 1.251 1.141 0 CA-C-O 117.661 -1.162 . . . . 0.0 109.054 -178.896 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 1.3 t . . . . . 0 N--CA 1.444 -0.726 0 CA-C-O 122.032 0.92 . . . . 0.0 108.83 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' B' B ' 16' ' ' VAL . . . . . 0.414 ' O ' ' HA ' ' A' ' 21' ' ' ARG . 19.4 t -114.39 142.75 25.97 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.573 0 N-CA-C 105.771 -1.937 . . . . 0.0 105.771 179.325 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 12.4 p -135.8 108.93 9.17 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 N-CA-C 106.188 -1.782 . . . . 0.0 106.188 178.675 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 43.4 ttm-85 -134.38 150.04 50.87 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-N 115.855 -0.612 . . . . 0.0 110.1 -179.745 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 22.5 m -88.57 75.45 8.32 Favored 'General case' 0 N--CA 1.45 -0.459 0 C-N-CA 125.264 1.426 . . . . 0.0 108.265 179.801 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 16.6 tp -86.44 136.99 32.9 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 105.947 -1.872 . . . . 0.0 105.947 178.818 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 78.9 mtt180 -132.62 166.75 21.42 Favored 'General case' 0 N--CA 1.451 -0.42 0 C-N-CA 127.182 2.193 . . . . 0.0 110.094 -179.078 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 22' ' ' PHE . . . . . . . . . . . . . 87.6 m-85 -136.76 -178.04 5.01 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 124.611 1.164 . . . . 0.0 110.114 -179.721 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -105.83 173.48 3.2 Favored Pre-proline 0 CA--C 1.542 0.663 0 C-N-CA 124.181 0.992 . . . . 0.0 109.751 179.758 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 24' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -68.32 -37.83 12.99 Favored 'Trans proline' 0 C--N 1.347 0.471 0 C-N-CA 121.55 1.5 . . . . 0.0 114.371 -177.494 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 25' ' ' VAL . . . . . . . . . . . . . 81.6 t -74.97 -41.6 45.93 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.202 0 N-CA-C 108.793 -0.818 . . . . 0.0 108.793 179.489 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -60.39 -51.71 68.32 Favored 'General case' 0 N--CA 1.45 -0.469 0 C-N-CA 126.559 1.944 . . . . 0.0 109.941 -178.776 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 27' ' ' ASP . . . . . . . . . . . . . 16.8 t70 -61.11 -49.85 75.64 Favored 'General case' 0 CA--C 1.512 -0.515 0 C-N-CA 124.732 1.213 . . . . 0.0 110.676 179.601 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 28' ' ' GLU . . . . . . . . . . . . . 31.1 tt0 -58.85 -45.23 90.58 Favored 'General case' 0 N--CA 1.447 -0.601 0 N-CA-C 109.106 -0.701 . . . . 0.0 109.106 -179.757 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 99.1 m -59.97 -55.93 27.93 Favored 'General case' 0 CA--C 1.53 0.199 0 CA-C-N 118.677 0.671 . . . . 0.0 109.288 179.062 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 65.6 mt -55.6 -42.93 71.0 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.215 0 C-N-CA 123.012 0.525 . . . . 0.0 109.912 -179.76 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 77.3 ttt180 -64.41 -44.6 90.73 Favored 'General case' 0 N--CA 1.45 -0.442 0 CA-C-O 118.336 -0.84 . . . . 0.0 111.246 -179.185 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 1.6 mptp? -62.69 -47.19 84.73 Favored 'General case' 0 C--O 1.222 -0.363 0 CA-C-O 118.101 -0.952 . . . . 0.0 109.062 179.579 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 1.5 mptm? -61.83 -47.82 83.37 Favored 'General case' 0 CA--C 1.518 -0.272 0 CA-C-N 119.48 1.036 . . . . 0.0 110.369 -179.736 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 34' ' ' ALA . . . . . . . . . . . . . . . -54.63 -57.86 9.79 Favored 'General case' 0 N--CA 1.448 -0.554 0 C-N-CA 124.94 1.296 . . . . 0.0 109.866 179.456 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 41.3 tt0 -61.81 -41.59 97.95 Favored 'General case' 0 N--CA 1.464 0.273 0 C-N-CA 124.649 1.18 . . . . 0.0 112.271 -178.946 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 36' ' ' ASP . . . . . . . . . . . . . 4.8 t70 -61.02 -42.32 98.24 Favored 'General case' 0 C--N 1.332 -0.184 0 C-N-CA 124.613 1.165 . . . . 0.0 108.393 179.617 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 37' ' ' SER . . . . . . . . . . . . . 29.5 t -77.68 -7.82 57.01 Favored 'General case' 0 N--CA 1.445 -0.684 0 C-N-CA 124.598 1.159 . . . . 0.0 110.839 179.107 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 77.13 15.05 81.97 Favored Glycine 0 CA--C 1.523 0.563 0 CA-C-O 117.061 -1.966 . . . . 0.0 115.998 178.895 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 39' ' ' LEU . . . . . . . . . . . . . 8.3 mt -120.68 143.37 48.76 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-N 120.892 2.346 . . . . 0.0 106.214 179.542 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 40' ' ' THR . . . . . . . . . . . . . 10.1 t -63.85 152.16 40.42 Favored 'General case' 0 C--N 1.321 -0.671 0 O-C-N 120.964 -1.085 . . . . 0.0 108.393 178.939 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 41' ' ' VAL . . . . . . . . . . . . . 52.6 t -48.07 -42.02 10.27 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.254 0 C-N-CA 125.267 1.427 . . . . 0.0 111.452 179.319 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 42' ' ' SER . . . . . . . . . . . . . 70.7 m -57.94 -43.09 86.14 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-N 120.301 1.409 . . . . 0.0 111.716 179.923 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -65.11 -51.04 63.63 Favored 'General case' 0 N--CA 1.452 -0.345 0 N-CA-C 107.529 -1.286 . . . . 0.0 107.529 178.087 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 44' ' ' TYR . . . . . . . . . . . . . 69.5 t80 -53.98 -45.71 71.49 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 123.548 0.739 . . . . 0.0 111.362 -179.647 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 45' ' ' ILE . . . . . . . . . . . . . 16.0 mm -59.47 -68.43 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.34 0.184 0 C-N-CA 125.352 1.461 . . . . 0.0 109.904 179.718 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 46' ' ' ARG . . . . . . . . . . . . . 17.8 ptt85 -51.65 -44.92 63.18 Favored 'General case' 0 C--O 1.219 -0.538 0 CA-C-O 118.971 -0.538 . . . . 0.0 110.537 -178.373 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 47' ' ' ASN . . . . . . . . . . . . . 32.4 t30 -62.43 -47.78 82.56 Favored 'General case' 0 N--CA 1.444 -0.758 0 CA-C-O 117.639 -1.172 . . . . 0.0 112.47 -179.008 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -64.41 -29.14 70.2 Favored 'General case' 0 CA--C 1.531 0.237 0 CA-C-N 119.115 0.87 . . . . 0.0 110.514 179.544 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 49' ' ' ALA . . . . . . . . . . . . . . . -73.75 -21.28 60.25 Favored 'General case' 0 CA--C 1.539 0.522 0 N-CA-C 112.494 0.554 . . . . 0.0 112.494 179.575 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 6.3 mt -101.33 -33.79 9.88 Favored 'General case' 0 N--CA 1.463 0.223 0 C-N-CA 124.532 1.133 . . . . 0.0 109.783 -179.085 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 51' ' ' ASN . . . . . . . . . . . . . 69.4 m-80 . . . . . 0 C--O 1.253 1.263 0 C-N-CA 125.671 1.589 . . . . 0.0 109.11 178.984 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 3.9 t . . . . . 0 N--CA 1.447 -0.587 0 N-CA-C 108.605 -0.887 . . . . 0.0 108.605 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 4.1 t -109.0 138.77 34.58 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.635 0 N-CA-C 103.65 -2.722 . . . . 0.0 103.65 178.164 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 11.5 p -140.73 117.26 7.9 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.388 0 N-CA-C 106.639 -1.615 . . . . 0.0 106.639 178.89 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 33.3 ttt180 -150.19 173.31 14.07 Favored 'General case' 0 C--O 1.236 0.375 0 N-CA-C 107.835 -1.172 . . . . 0.0 107.835 -179.782 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 27.1 m -111.46 120.35 41.87 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 104.895 -2.261 . . . . 0.0 104.895 179.078 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -120.62 104.68 10.12 Favored 'General case' 0 N--CA 1.449 -0.511 0 N-CA-C 106.32 -1.733 . . . . 0.0 106.32 179.484 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 26.3 mtm-85 -84.98 157.16 20.86 Favored 'General case' 0 N--CA 1.448 -0.543 0 N-CA-C 109.662 -0.495 . . . . 0.0 109.662 178.874 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 97.5 m-85 -137.66 163.42 31.3 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 108.321 -0.992 . . . . 0.0 108.321 179.936 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 19.3 m -91.98 168.3 13.32 Favored Pre-proline 0 CA--C 1.547 0.834 0 CA-C-O 118.154 -0.927 . . . . 0.0 108.53 179.734 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 45.8 Cg_endo -63.14 -41.97 25.41 Favored 'Trans proline' 0 C--N 1.348 0.529 0 C-N-CA 121.72 1.613 . . . . 0.0 113.03 -177.499 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 65.6 t -68.2 -26.61 34.52 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.363 0 C-N-CA 123.963 0.905 . . . . 0.0 110.561 -179.654 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 4.2 mm-40 -81.65 -38.12 26.42 Favored 'General case' 0 C--N 1.333 -0.124 0 C-N-CA 124.083 0.953 . . . . 0.0 109.572 -179.297 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -69.04 -44.08 73.38 Favored 'General case' 0 C--O 1.221 -0.416 0 C-N-CA 125.429 1.492 . . . . 0.0 108.636 178.626 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 24.6 tt0 -54.22 -52.32 61.64 Favored 'General case' 0 N--CA 1.451 -0.382 0 C-N-CA 126.615 1.966 . . . . 0.0 109.455 179.064 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 72.8 m -65.79 -52.01 54.31 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-O 118.969 -0.538 . . . . 0.0 110.915 -179.4 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 71.1 mt -58.53 -41.75 82.71 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.261 0 CA-C-N 118.191 0.451 . . . . 0.0 110.611 -178.694 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 50.7 ttt85 -64.94 -48.66 73.32 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-O 118.868 -0.586 . . . . 0.0 110.352 -179.516 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 11.7 mptt -63.87 -46.88 82.97 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-O 118.737 -0.649 . . . . 0.0 111.002 -179.243 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.8 -43.38 98.95 Favored 'General case' 0 C--O 1.228 -0.041 0 CA-C-N 118.63 0.65 . . . . 0.0 110.218 -179.508 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -59.16 -52.74 64.42 Favored 'General case' 0 N--CA 1.454 -0.25 0 C-N-CA 123.842 0.857 . . . . 0.0 110.128 179.455 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 18.0 tt0 -59.39 -39.25 82.74 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 123.392 0.677 . . . . 0.0 111.784 -178.896 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -71.3 -40.91 70.56 Favored 'General case' 0 N--CA 1.463 0.196 0 CA-C-N 118.416 0.553 . . . . 0.0 109.913 178.841 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 23.1 t -69.38 -9.04 51.72 Favored 'General case' 0 N--CA 1.448 -0.542 0 C-N-CA 123.606 0.762 . . . . 0.0 110.66 179.788 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 67.42 20.74 71.88 Favored Glycine 0 CA--C 1.527 0.83 0 CA-C-N 119.061 0.846 . . . . 0.0 111.064 -179.203 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 70.6 mt -117.71 116.79 27.74 Favored 'General case' 0 CA--C 1.513 -0.474 0 N-CA-C 104.148 -2.538 . . . . 0.0 104.148 179.791 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 5.2 t -54.24 152.2 6.48 Favored 'General case' 0 CA--C 1.539 0.533 0 N-CA-C 108.551 -0.907 . . . . 0.0 108.551 179.171 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 53.1 t -45.71 -43.25 4.08 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.224 0 C-N-CA 124.02 0.928 . . . . 0.0 111.629 -179.479 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 8.9 p -59.35 -47.03 86.94 Favored 'General case' 0 CA--C 1.536 0.42 0 O-C-N 121.58 -0.7 . . . . 0.0 111.614 -179.954 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -67.01 -43.25 83.36 Favored 'General case' 0 N--CA 1.454 -0.226 0 C-N-CA 124.454 1.102 . . . . 0.0 109.967 178.992 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 36.2 t80 -53.74 -51.38 63.54 Favored 'General case' 0 N--CA 1.453 -0.319 0 C-N-CA 125.265 1.426 . . . . 0.0 109.137 179.684 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 8.3 mm -53.82 -63.21 0.55 Allowed 'Isoleucine or valine' 0 CA--C 1.529 0.14 0 C-N-CA 124.668 1.187 . . . . 0.0 110.093 179.733 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 6.9 ptm180 -56.83 -44.99 82.6 Favored 'General case' 0 C--O 1.224 -0.28 0 CA-C-O 118.296 -0.859 . . . . 0.0 112.718 -178.744 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 25.5 t30 -59.55 -53.07 62.38 Favored 'General case' 0 C--O 1.232 0.143 0 C-N-CA 124.449 1.1 . . . . 0.0 110.468 -179.912 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -62.67 -33.09 74.36 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 123.316 0.646 . . . . 0.0 111.324 179.834 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -75.26 -15.34 60.53 Favored 'General case' 0 CA--C 1.536 0.421 0 N-CA-C 114.128 1.158 . . . . 0.0 114.128 -179.673 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 17.6 mt -107.05 -34.77 7.07 Favored 'General case' 0 CA--C 1.517 -0.297 0 CA-C-N 119.426 1.012 . . . . 0.0 112.418 -179.889 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 56.2 m-80 . . . . . 0 C--O 1.247 0.968 0 C-N-CA 123.654 0.782 . . . . 0.0 111.595 -178.981 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 4.1 t . . . . . 0 N--CA 1.439 -0.985 0 CA-C-O 122.142 0.972 . . . . 0.0 110.548 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 36.0 t -101.51 152.42 5.27 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 N-CA-C 105.409 -2.071 . . . . 0.0 105.409 178.422 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 11.1 p -147.66 110.82 0.72 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 N-CA-C 103.501 -2.777 . . . . 0.0 103.501 178.121 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 32.2 ttt180 -145.0 158.71 43.73 Favored 'General case' 0 C--O 1.233 0.197 0 O-C-N 121.274 -0.891 . . . . 0.0 113.299 -178.425 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 3.9 m -92.23 80.18 5.03 Favored 'General case' 0 N--CA 1.451 -0.377 0 C-N-CA 125.998 1.719 . . . . 0.0 107.812 -179.361 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -85.62 93.02 8.72 Favored 'General case' 0 C--N 1.326 -0.439 0 O-C-N 121.32 -0.863 . . . . 0.0 109.102 -179.453 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 14.5 mmm-85 -78.44 154.2 30.82 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 122.987 0.515 . . . . 0.0 110.179 179.101 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 22' ' ' PHE . . . . . . . . . . . . . 92.0 m-85 -141.35 174.18 10.78 Favored 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 125.506 1.522 . . . . 0.0 108.269 179.139 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 23' ' ' SER . . . . . 0.448 ' HB3' ' HD2' ' B' ' 24' ' ' PRO . 3.2 m -104.25 176.66 1.67 Allowed Pre-proline 0 CA--C 1.544 0.716 0 CA-C-O 117.809 -1.091 . . . . 0.0 110.124 179.562 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 24' ' ' PRO . . . . . 0.448 ' HD2' ' HB3' ' B' ' 23' ' ' SER . 85.7 Cg_endo -77.17 -29.0 5.35 Favored 'Trans proline' 0 C--N 1.35 0.62 0 CA-C-N 121.519 1.578 . . . . 0.0 112.634 -178.107 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 25' ' ' VAL . . . . . . . . . . . . . 11.4 t -75.66 -34.66 29.34 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.177 0 N-CA-C 107.295 -1.372 . . . . 0.0 107.295 179.237 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -69.08 -45.63 69.8 Favored 'General case' 0 N--CA 1.447 -0.595 0 N-CA-C 107.48 -1.304 . . . . 0.0 107.48 178.41 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 27' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -60.7 -49.3 78.05 Favored 'General case' 0 C--O 1.218 -0.601 0 N-CA-C 109.194 -0.669 . . . . 0.0 109.194 179.097 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 28' ' ' GLU . . . . . . . . . . . . . 36.4 tt0 -61.32 -23.03 65.43 Favored 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 123.965 0.906 . . . . 0.0 111.48 -179.806 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 88.6 m -85.21 -53.92 4.94 Favored 'General case' 0 N--CA 1.452 -0.35 0 N-CA-C 108.035 -1.098 . . . . 0.0 108.035 178.616 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 58.8 mt -58.43 -46.16 89.57 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.507 0 C-N-CA 124.591 1.156 . . . . 0.0 110.18 -179.278 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 54.0 ttt85 -59.98 -52.33 65.87 Favored 'General case' 0 N--CA 1.451 -0.387 0 C-N-CA 124.299 1.04 . . . . 0.0 110.142 -179.456 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 5.9 mptt -59.42 -48.44 81.65 Favored 'General case' 0 N--CA 1.456 -0.164 0 O-C-N 123.711 0.632 . . . . 0.0 110.499 -179.073 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -67.02 -38.46 86.0 Favored 'General case' 0 C--O 1.226 -0.158 0 CA-C-N 118.123 0.42 . . . . 0.0 112.085 -178.586 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 34' ' ' ALA . . . . . . . . . . . . . . . -59.94 -52.81 63.82 Favored 'General case' 0 N--CA 1.452 -0.371 0 C-N-CA 124.015 0.926 . . . . 0.0 108.79 179.034 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 5.9 tt0 -65.73 -30.84 71.57 Favored 'General case' 0 CA--C 1.534 0.348 0 O-C-N 122.217 -0.302 . . . . 0.0 110.755 -178.962 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 36' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -67.32 -42.29 83.86 Favored 'General case' 0 N--CA 1.462 0.147 0 C-N-CA 124.264 1.026 . . . . 0.0 108.242 178.697 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 37' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -74.51 -21.57 59.48 Favored 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 124.356 1.063 . . . . 0.0 110.675 178.781 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 85.56 -5.93 81.91 Favored Glycine 0 CA--C 1.537 1.428 0 N-CA-C 109.71 -1.356 . . . . 0.0 109.71 -177.688 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 39' ' ' LEU . . . . . . . . . . . . . 84.4 mt -89.01 110.27 20.99 Favored 'General case' 0 N--CA 1.445 -0.687 0 C-N-CA 128.144 2.578 . . . . 0.0 105.68 179.312 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 40' ' ' THR . . . . . . . . . . . . . 5.0 t -48.04 155.2 0.47 Allowed 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 123.777 0.831 . . . . 0.0 109.589 178.184 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 41' ' ' VAL . . . . . . . . . . . . . 52.9 t -45.65 -43.2 3.95 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.505 0 C-N-CA 124.479 1.112 . . . . 0.0 111.441 -179.392 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 42' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -64.26 -35.64 81.49 Favored 'General case' 0 CA--C 1.542 0.638 0 O-C-N 121.487 -0.758 . . . . 0.0 112.93 179.823 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -76.25 -44.51 37.09 Favored 'General case' 0 C--O 1.226 -0.162 0 C-N-CA 126.277 1.831 . . . . 0.0 108.957 178.579 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 44' ' ' TYR . . . . . . . . . . . . . 64.0 t80 -55.69 -51.93 65.59 Favored 'General case' 0 N--CA 1.446 -0.659 0 C-N-CA 124.812 1.245 . . . . 0.0 109.256 179.5 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 45' ' ' ILE . . . . . . . . . . . . . 21.6 mm -54.96 -60.43 1.6 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.395 0 C-N-CA 123.86 0.864 . . . . 0.0 111.739 179.653 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 46' ' ' ARG . . . . . . . . . . . . . 3.3 ptm180 -53.91 -45.58 71.21 Favored 'General case' 0 C--O 1.224 -0.246 0 CA-C-O 118.429 -0.796 . . . . 0.0 111.368 -179.508 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 47' ' ' ASN . . . . . . . . . . . . . 27.4 t30 -62.24 -57.02 12.96 Favored 'General case' 0 N--CA 1.452 -0.343 0 C-N-CA 124.939 1.296 . . . . 0.0 110.878 -179.473 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -58.13 -30.58 66.44 Favored 'General case' 0 C--N 1.334 -0.093 0 C-N-CA 123.891 0.876 . . . . 0.0 113.264 -178.725 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 49' ' ' ALA . . . . . . . . . . . . . . . -82.58 -29.35 30.31 Favored 'General case' 0 N--CA 1.451 -0.41 0 N-CA-C 114.274 1.213 . . . . 0.0 114.274 -179.208 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 43.7 mt -84.88 -37.6 20.43 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-N 119.084 0.856 . . . . 0.0 111.171 -179.234 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 51' ' ' ASN . . . . . . . . . . . . . 63.5 m-20 . . . . . 0 C--O 1.251 1.149 0 CA-C-O 116.576 -1.678 . . . . 0.0 110.324 179.33 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 4.1 t . . . . . 0 N--CA 1.437 -1.097 0 CA-C-O 122.161 0.981 . . . . 0.0 108.355 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 24.7 t -109.71 147.03 14.39 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.763 0 N-CA-C 104.437 -2.431 . . . . 0.0 104.437 176.665 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 11.3 p -143.44 105.45 1.01 Allowed 'Isoleucine or valine' 0 N--CA 1.445 -0.709 0 N-CA-C 104.431 -2.433 . . . . 0.0 104.431 178.198 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 49.5 ttm-85 -148.34 156.02 42.0 Favored 'General case' 0 C--N 1.325 -0.462 0 C-N-CA 123.245 0.618 . . . . 0.0 109.743 -179.344 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 23.4 m -103.62 129.7 50.94 Favored 'General case' 0 N--CA 1.451 -0.402 0 N-CA-C 104.07 -2.567 . . . . 0.0 104.07 178.445 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -135.98 111.66 9.36 Favored 'General case' 0 N--CA 1.453 -0.322 0 N-CA-C 108.163 -1.051 . . . . 0.0 108.163 -178.413 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 89.4 mtm-85 -86.06 138.93 31.58 Favored 'General case' 0 N--CA 1.462 0.168 0 CA-C-O 117.369 -1.3 . . . . 0.0 112.345 -178.805 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 32.2 m-85 -123.0 159.39 28.47 Favored 'General case' 0 N--CA 1.481 1.112 0 C-N-CA 127.12 2.168 . . . . 0.0 110.195 -178.62 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 23' ' ' SER . . . . . 0.401 ' HB3' ' HD2' ' A' ' 24' ' ' PRO . 1.9 m -80.75 167.72 30.48 Favored Pre-proline 0 CA--C 1.541 0.614 0 CA-C-N 119.097 0.862 . . . . 0.0 109.691 179.7 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 24' ' ' PRO . . . . . 0.401 ' HD2' ' HB3' ' A' ' 23' ' ' SER . 41.8 Cg_endo -65.25 -42.17 14.19 Favored 'Trans proline' 0 N--CA 1.459 -0.535 0 C-N-CA 121.929 1.752 . . . . 0.0 112.373 -179.653 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 77.1 t -58.39 -53.07 51.47 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.315 0 N-CA-C 108.075 -1.083 . . . . 0.0 108.075 179.757 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 -56.84 -46.03 81.98 Favored 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 124.451 1.1 . . . . 0.0 110.863 179.453 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 19.3 t70 -60.24 -50.1 75.01 Favored 'General case' 0 CA--C 1.512 -0.511 0 C-N-CA 124.072 0.949 . . . . 0.0 112.549 -179.618 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -60.24 -43.61 95.93 Favored 'General case' 0 N--CA 1.452 -0.338 0 N-CA-C 109.645 -0.502 . . . . 0.0 109.645 -179.783 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 63.1 m -58.71 -54.42 47.29 Favored 'General case' 0 N--CA 1.451 -0.385 0 N-CA-C 109.293 -0.632 . . . . 0.0 109.293 179.448 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 78.3 mt -58.14 -45.58 88.56 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.362 0 C-N-CA 123.008 0.523 . . . . 0.0 109.727 -179.673 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 29.1 ttt180 -61.65 -43.61 98.53 Favored 'General case' 0 C--N 1.334 -0.076 0 O-C-N 121.358 -0.839 . . . . 0.0 112.225 -178.941 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -68.81 -47.69 65.46 Favored 'General case' 0 CA--C 1.528 0.127 0 CA-C-N 118.915 0.78 . . . . 0.0 109.922 -179.7 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 71.8 mmtt -63.93 -46.42 84.82 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-N 118.819 0.736 . . . . 0.0 112.098 -178.885 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -60.01 -52.48 65.19 Favored 'General case' 0 N--CA 1.448 -0.549 0 C-N-CA 122.53 0.332 . . . . 0.0 110.614 -179.482 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 26.9 tp10 -62.8 -37.35 86.37 Favored 'General case' 0 N--CA 1.454 -0.263 0 CA-C-N 116.594 -0.276 . . . . 0.0 111.4 -178.646 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -63.79 -38.89 92.79 Favored 'General case' 0 CA--C 1.527 0.059 0 N-CA-C 108.685 -0.857 . . . . 0.0 108.685 179.282 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 33.1 t -75.19 -10.45 59.48 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 123.76 0.824 . . . . 0.0 110.725 178.69 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 77.77 4.02 84.7 Favored Glycine 0 CA--C 1.528 0.861 0 O-C-N 120.791 -1.193 . . . . 0.0 113.246 179.365 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 1.8 mt -118.66 115.86 25.39 Favored 'General case' 0 CA--C 1.508 -0.656 0 N-CA-C 102.685 -3.08 . . . . 0.0 102.685 179.448 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 3.1 t -46.72 160.54 0.08 Allowed 'General case' 0 C--N 1.323 -0.552 0 C-N-CA 125.615 1.566 . . . . 0.0 112.499 -179.031 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 9.2 m -47.06 -38.39 4.36 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.591 0 N-CA-C 114.13 1.159 . . . . 0.0 114.13 -177.72 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 42' ' ' SER . . . . . 0.44 ' HA ' HD11 ' B' ' 20' ' ' LEU . 6.9 p -66.05 -52.2 51.24 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-N 119.485 1.039 . . . . 0.0 109.898 179.153 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -56.88 -43.44 81.27 Favored 'General case' 0 CA--C 1.531 0.223 0 C-N-CA 124.185 0.994 . . . . 0.0 109.356 178.185 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 83.3 t80 -58.51 -52.28 66.32 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 124.04 0.936 . . . . 0.0 108.952 178.794 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 2.4 mm -53.39 -63.8 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.343 0.308 0 C-N-CA 126.176 1.79 . . . . 0.0 110.011 179.76 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 2.4 ptm180 -56.13 -43.02 77.8 Favored 'General case' 0 CA--C 1.516 -0.347 0 CA-C-O 117.675 -1.155 . . . . 0.0 111.637 -178.693 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 9.3 t30 -61.3 -54.71 40.51 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 119.459 1.027 . . . . 0.0 110.49 179.368 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -60.16 -32.92 71.5 Favored 'General case' 0 C--O 1.224 -0.282 0 C-N-CA 123.479 0.712 . . . . 0.0 112.157 -179.17 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -71.39 -27.04 63.04 Favored 'General case' 0 CA--C 1.535 0.382 0 N-CA-C 112.975 0.732 . . . . 0.0 112.975 -179.663 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 19.4 mt -92.48 -35.66 13.51 Favored 'General case' 0 CA--C 1.518 -0.267 0 C-N-CA 123.413 0.685 . . . . 0.0 109.81 -179.758 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 78.4 m-20 . . . . . 0 C--O 1.251 1.133 0 C-N-CA 125.334 1.454 . . . . 0.0 109.669 -180.0 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 6.4 t . . . . . 0 N--CA 1.44 -0.967 0 CA-C-O 123.237 1.494 . . . . 0.0 109.885 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 36.4 t -102.42 146.53 10.31 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.873 0 N-CA-C 101.964 -3.347 . . . . 0.0 101.964 175.004 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 9.5 p -148.14 100.0 0.37 Allowed 'Isoleucine or valine' 0 N--CA 1.442 -0.861 0 N-CA-C 102.51 -3.144 . . . . 0.0 102.51 177.254 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 46.3 ttm-85 -142.34 160.51 40.11 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.057 -0.974 . . . . 0.0 109.282 -178.77 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -108.85 122.64 47.62 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 101.278 -3.601 . . . . 0.0 101.278 178.396 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 20' ' ' LEU . . . . . 0.44 HD11 ' HA ' ' A' ' 42' ' ' SER . 7.5 tt -134.44 112.62 11.08 Favored 'General case' 0 N--CA 1.463 0.208 0 C-N-CA 124.609 1.163 . . . . 0.0 109.199 -177.02 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 75.1 mtm-85 -78.98 162.45 25.95 Favored 'General case' 0 N--CA 1.47 0.562 0 N-CA-C 113.52 0.933 . . . . 0.0 113.52 -178.763 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 22' ' ' PHE . . . . . . . . . . . . . 45.4 m-85 -143.05 160.75 39.78 Favored 'General case' 0 N--CA 1.47 0.549 0 C-N-CA 127.117 2.167 . . . . 0.0 107.388 179.361 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 23' ' ' SER . . . . . 0.473 ' HB3' ' HD2' ' B' ' 24' ' ' PRO . 3.1 m -88.97 173.91 5.57 Favored Pre-proline 0 CA--C 1.545 0.756 0 C-N-CA 124.692 1.197 . . . . 0.0 109.899 179.823 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 24' ' ' PRO . . . . . 0.473 ' HD2' ' HB3' ' B' ' 23' ' ' SER . 55.7 Cg_endo -68.1 -47.47 1.72 Allowed 'Trans proline' 0 C--N 1.352 0.757 0 C-N-CA 121.687 1.591 . . . . 0.0 112.17 -178.543 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 25' ' ' VAL . . . . . . . . . . . . . 33.8 t -67.51 -31.23 51.76 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.388 0 C-N-CA 123.913 0.885 . . . . 0.0 110.296 -179.583 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 58.1 mt-10 -70.08 -48.7 56.66 Favored 'General case' 0 CA--C 1.529 0.137 0 N-CA-C 108.012 -1.107 . . . . 0.0 108.012 179.409 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 27' ' ' ASP . . . . . . . . . . . . . 23.8 t70 -60.38 -43.67 96.37 Favored 'General case' 0 C--O 1.219 -0.545 0 C-N-CA 124.968 1.307 . . . . 0.0 110.717 179.37 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 28' ' ' GLU . . . . . . . . . . . . . 12.9 tt0 -56.43 -52.2 65.54 Favored 'General case' 0 N--CA 1.454 -0.254 0 C-N-CA 124.768 1.227 . . . . 0.0 110.146 -179.696 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 4.1 m -56.71 -55.48 33.62 Favored 'General case' 0 CA--C 1.53 0.199 0 N-CA-C 109.118 -0.697 . . . . 0.0 109.118 178.96 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 73.2 mt -54.12 -50.92 51.58 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.202 0 C-N-CA 123.279 0.631 . . . . 0.0 110.845 -178.986 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 58.9 ttt180 -56.89 -48.31 78.47 Favored 'General case' 0 N--CA 1.449 -0.507 0 C-N-CA 124.587 1.155 . . . . 0.0 111.331 -178.952 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 1.9 mptm? -65.65 -45.98 80.93 Favored 'General case' 0 CA--C 1.515 -0.398 0 O-C-N 123.909 0.756 . . . . 0.0 110.379 -179.519 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 34.9 mmtt -62.47 -44.6 96.0 Favored 'General case' 0 C--N 1.333 -0.117 0 CA-C-N 119.455 1.025 . . . . 0.0 110.239 -179.02 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 34' ' ' ALA . . . . . . . . . . . . . . . -58.2 -54.61 45.05 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 124.866 1.267 . . . . 0.0 110.024 179.192 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 7.4 tp10 -66.57 -16.78 64.41 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 124.635 1.174 . . . . 0.0 112.775 -179.055 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 36' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -102.05 4.61 39.95 Favored 'General case' 0 C--N 1.327 -0.409 0 C-N-CA 126.015 1.726 . . . . 0.0 111.466 -179.899 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 37' ' ' SER . . . . . . . . . . . . . 9.1 t -127.59 -1.27 6.15 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 124.424 1.09 . . . . 0.0 112.094 179.825 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 67.79 28.72 73.45 Favored Glycine 0 CA--C 1.529 0.936 0 CA-C-N 119.876 1.216 . . . . 0.0 110.64 -178.892 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 39' ' ' LEU . . . . . . . . . . . . . 90.0 mt -120.1 125.24 47.79 Favored 'General case' 0 N--CA 1.444 -0.725 0 C-N-CA 126.041 1.736 . . . . 0.0 106.94 -179.061 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 40' ' ' THR . . . . . 0.543 HG23 ' H ' ' B' ' 43' ' ' ALA . 1.8 t -63.8 153.83 35.33 Favored 'General case' 0 CA--C 1.538 0.502 0 N-CA-C 104.703 -2.332 . . . . 0.0 104.703 176.8 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 41' ' ' VAL . . . . . . . . . . . . . 55.1 t -48.64 -38.75 10.01 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.498 0 O-C-N 121.392 -0.818 . . . . 0.0 110.261 179.071 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 42' ' ' SER . . . . . . . . . . . . . 14.4 m -62.39 -46.55 88.09 Favored 'General case' 0 CA--C 1.533 0.324 0 O-C-N 121.057 -1.027 . . . . 0.0 111.368 179.085 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 43' ' ' ALA . . . . . 0.543 ' H ' HG23 ' B' ' 40' ' ' THR . . . -64.9 -40.91 95.83 Favored 'General case' 0 C--N 1.34 0.164 0 C-N-CA 123.913 0.885 . . . . 0.0 109.23 178.803 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 44' ' ' TYR . . . . . . . . . . . . . 57.3 t80 -58.45 -50.92 71.99 Favored 'General case' 0 CA--C 1.539 0.54 0 N-CA-C 108.276 -1.009 . . . . 0.0 108.276 179.106 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 45' ' ' ILE . . . . . . . . . . . . . 12.9 mm -56.74 -61.32 1.26 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.301 0 C-N-CA 125.122 1.369 . . . . 0.0 108.609 178.807 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 46' ' ' ARG . . . . . . . . . . . . . 40.2 mtp180 -43.9 -66.01 0.43 Allowed 'General case' 0 C--O 1.219 -0.51 0 C-N-CA 126.044 1.738 . . . . 0.0 110.588 179.781 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 47' ' ' ASN . . . . . . . . . . . . . 20.5 t30 -53.25 -49.54 66.67 Favored 'General case' 0 N--CA 1.441 -0.88 0 C-N-CA 124.719 1.208 . . . . 0.0 113.601 -178.04 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -63.18 -31.62 72.81 Favored 'General case' 0 CA--C 1.535 0.399 0 CA-C-N 118.99 0.814 . . . . 0.0 111.264 179.514 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 49' ' ' ALA . . . . . . . . . . . . . . . -78.68 -16.09 57.7 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 124.067 0.947 . . . . 0.0 113.512 -179.712 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 13.9 mt -100.32 -38.02 8.63 Favored 'General case' 0 C--O 1.234 0.283 0 O-C-N 121.451 -0.781 . . . . 0.0 109.981 179.886 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 51' ' ' ASN . . . . . . . . . . . . . 43.2 m-80 . . . . . 0 C--O 1.246 0.907 0 C-N-CA 124.502 1.121 . . . . 0.0 110.136 179.155 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 12.2 t . . . . . 0 N--CA 1.436 -1.159 0 CA-C-O 124.107 1.908 . . . . 0.0 110.89 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 16.1 t -122.92 144.19 33.26 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.961 1 N-CA-C 100.072 -4.047 . . . . 0.0 100.072 176.51 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 13.1 p -136.9 102.08 2.57 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.021 0 N-CA-C 104.244 -2.502 . . . . 0.0 104.244 179.234 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 6.0 mtt-85 -128.25 158.96 36.7 Favored 'General case' 0 CA--C 1.509 -0.603 0 CA-C-O 123.103 1.43 . . . . 0.0 109.792 -179.969 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 3.7 m -94.2 83.21 4.21 Favored 'General case' 0 N--CA 1.439 -1.003 0 N-CA-C 104.049 -2.574 . . . . 0.0 104.049 -179.234 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -84.17 92.67 7.98 Favored 'General case' 0 C--N 1.325 -0.458 0 C-N-CA 124.294 1.037 . . . . 0.0 111.058 -177.771 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -74.2 146.48 43.34 Favored 'General case' 0 N--CA 1.447 -0.596 0 C-N-CA 123.961 0.904 . . . . 0.0 112.666 179.204 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 90.5 m-85 -137.11 152.29 49.83 Favored 'General case' 0 C--O 1.238 0.458 0 C-N-CA 126.624 1.97 . . . . 0.0 106.088 177.274 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 1.2 m -86.52 167.68 21.82 Favored Pre-proline 0 CA--C 1.543 0.692 0 N-CA-C 106.59 -1.633 . . . . 0.0 106.59 179.438 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -66.76 -30.84 40.73 Favored 'Trans proline' 0 CA--C 1.531 0.368 0 CA-C-N 121.201 1.465 . . . . 0.0 111.428 -179.355 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 44.8 t -69.32 -45.29 79.35 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.322 0 N-CA-C 108.456 -0.942 . . . . 0.0 108.456 179.308 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -64.37 -46.24 84.26 Favored 'General case' 0 C--O 1.224 -0.276 0 N-CA-C 109.52 -0.548 . . . . 0.0 109.52 -179.789 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -58.35 -44.21 88.66 Favored 'General case' 0 CA--C 1.513 -0.458 0 C-N-CA 123.874 0.87 . . . . 0.0 111.233 -179.772 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 15.3 tm-20 -62.24 -51.39 67.95 Favored 'General case' 0 N--CA 1.448 -0.565 0 N-CA-C 109.166 -0.679 . . . . 0.0 109.166 179.856 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 88.9 m -59.38 -53.41 58.56 Favored 'General case' 0 CA--C 1.534 0.34 0 CA-C-N 118.353 0.524 . . . . 0.0 110.009 179.482 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 83.9 mt -57.97 -43.53 85.0 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.293 0 C-N-CA 124.193 0.997 . . . . 0.0 109.861 -179.283 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 40.8 ttt180 -62.94 -42.23 99.74 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-N 119.296 0.953 . . . . 0.0 110.16 -179.63 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 4.7 mptp? -68.98 -47.71 64.91 Favored 'General case' 0 CA--C 1.515 -0.38 0 CA-C-O 118.843 -0.598 . . . . 0.0 109.864 -179.554 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 21.3 tptt -63.01 -41.1 99.48 Favored 'General case' 0 C--O 1.224 -0.27 0 CA-C-O 119.005 -0.521 . . . . 0.0 110.536 -179.488 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -61.08 -53.45 57.0 Favored 'General case' 0 N--CA 1.453 -0.294 0 C-N-CA 124.841 1.257 . . . . 0.0 109.236 179.071 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 30.5 tt0 -57.84 -44.23 86.38 Favored 'General case' 0 N--CA 1.453 -0.303 0 C-N-CA 122.966 0.507 . . . . 0.0 111.17 -179.299 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 27.0 t0 -67.33 -39.61 85.86 Favored 'General case' 0 C--N 1.332 -0.156 0 C-N-CA 123.378 0.671 . . . . 0.0 109.9 -179.85 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 22.9 t -72.3 -9.17 58.14 Favored 'General case' 0 N--CA 1.451 -0.403 0 C-N-CA 124.53 1.132 . . . . 0.0 111.007 179.66 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 65.49 29.76 75.95 Favored Glycine 0 CA--C 1.53 1.012 0 CA-C-N 119.391 0.996 . . . . 0.0 111.683 -179.682 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 71.6 mt -133.42 115.65 15.09 Favored 'General case' 0 N--CA 1.451 -0.42 0 N-CA-C 103.797 -2.668 . . . . 0.0 103.797 179.703 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 14.8 t -57.13 161.65 3.01 Favored 'General case' 0 CA--C 1.535 0.391 0 CA-C-N 119.276 0.944 . . . . 0.0 110.19 -179.843 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 97.7 t -44.19 -45.77 2.24 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.213 0 C-N-CA 126.118 1.767 . . . . 0.0 111.555 -178.812 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 2.5 p -64.19 -47.49 79.58 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-N 120.304 1.411 . . . . 0.0 112.076 -179.806 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -62.1 -44.28 97.0 Favored 'General case' 0 C--O 1.222 -0.353 0 C-N-CA 124.412 1.085 . . . . 0.0 109.176 178.69 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 61.2 t80 -59.27 -51.07 71.55 Favored 'General case' 0 N--CA 1.453 -0.322 0 C-N-CA 125.403 1.481 . . . . 0.0 108.798 179.073 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 45' ' ' ILE . . . . . 0.411 HG23 HG23 ' B' ' 45' ' ' ILE . 13.8 mm -55.19 -60.32 1.73 Allowed 'Isoleucine or valine' 0 C--O 1.226 -0.132 0 C-N-CA 124.408 1.083 . . . . 0.0 110.163 179.705 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 21.2 ptt180 -59.93 -44.64 94.21 Favored 'General case' 0 C--O 1.219 -0.524 0 CA-C-O 118.366 -0.826 . . . . 0.0 110.499 -179.2 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 18.0 t30 -53.57 -56.73 14.6 Favored 'General case' 0 CA--C 1.519 -0.215 0 CA-C-N 119.374 0.988 . . . . 0.0 110.079 179.875 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -61.42 -33.13 73.19 Favored 'General case' 0 N--CA 1.453 -0.284 0 C-N-CA 124.174 0.99 . . . . 0.0 112.245 -179.81 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -75.5 -24.42 56.85 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 123.441 0.696 . . . . 0.0 112.874 -179.588 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 11.8 mt -98.55 -29.19 13.22 Favored 'General case' 0 N--CA 1.465 0.298 0 C-N-CA 123.583 0.753 . . . . 0.0 111.325 -179.399 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 43.3 m-80 . . . . . 0 C--O 1.243 0.75 0 C-N-CA 126.655 1.982 . . . . 0.0 108.378 -179.846 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 4.5 t . . . . . 0 N--CA 1.442 -0.841 0 N-CA-C 108.852 -0.796 . . . . 0.0 108.852 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 21.4 t -105.56 120.28 56.1 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.53 0 N-CA-C 104.58 -2.378 . . . . 0.0 104.58 178.674 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 9.4 p -115.59 90.7 1.58 Allowed 'Isoleucine or valine' 0 N--CA 1.447 -0.6 0 N-CA-C 106.233 -1.766 . . . . 0.0 106.233 178.717 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -117.77 161.64 19.37 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 114.234 -1.348 . . . . 0.0 109.185 -179.857 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 56.3 m -104.99 88.68 2.93 Favored 'General case' 0 N--CA 1.448 -0.526 0 N-CA-C 105.155 -2.165 . . . . 0.0 105.155 -179.654 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -90.7 105.6 17.94 Favored 'General case' 0 C--N 1.324 -0.514 0 C-N-CA 125.612 1.565 . . . . 0.0 110.894 -178.47 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 1.4 mpp_? -82.55 154.07 25.21 Favored 'General case' 0 N--CA 1.455 -0.216 0 C-N-CA 123.548 0.739 . . . . 0.0 111.555 178.847 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 22' ' ' PHE . . . . . . . . . . . . . 81.7 m-85 -138.35 141.69 39.7 Favored 'General case' 0 CA--C 1.516 -0.342 0 N-CA-C 106.624 -1.621 . . . . 0.0 106.624 178.129 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 14.5 m -71.61 165.76 46.12 Favored Pre-proline 0 CA--C 1.539 0.556 0 N-CA-C 109.318 -0.623 . . . . 0.0 109.318 179.653 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 24' ' ' PRO . . . . . . . . . . . . . 33.9 Cg_endo -62.36 -38.52 53.04 Favored 'Trans proline' 0 C--N 1.348 0.529 0 C-N-CA 121.457 1.438 . . . . 0.0 111.145 -179.4 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 25' ' ' VAL . . . . . . . . . . . . . 60.5 t -65.42 -49.39 78.71 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.254 0 C-N-CA 124.433 1.093 . . . . 0.0 109.346 179.41 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 54.8 mt-10 -58.96 -49.33 78.26 Favored 'General case' 0 C--O 1.223 -0.335 0 C-N-CA 124.097 0.959 . . . . 0.0 109.743 -179.716 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 27' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -59.83 -39.04 83.73 Favored 'General case' 0 N--CA 1.453 -0.306 0 C-N-CA 124.753 1.221 . . . . 0.0 111.771 -179.832 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 28' ' ' GLU . . . . . . . . . . . . . 12.4 tt0 -66.61 -53.33 35.44 Favored 'General case' 0 N--CA 1.453 -0.315 0 N-CA-C 109.231 -0.655 . . . . 0.0 109.231 179.551 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 64.8 m -57.63 -50.58 72.67 Favored 'General case' 0 N--CA 1.454 -0.251 0 C-N-CA 124.064 0.945 . . . . 0.0 110.02 179.438 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 81.3 mt -60.78 -42.93 94.12 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.354 0 C-N-CA 123.564 0.746 . . . . 0.0 109.275 -179.676 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 56.8 ttt180 -61.42 -51.01 70.52 Favored 'General case' 0 CA--C 1.519 -0.213 0 CA-C-N 119.296 0.953 . . . . 0.0 110.211 179.261 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 5.0 mptp? -60.77 -44.16 97.11 Favored 'General case' 0 CA--C 1.52 -0.195 0 CA-C-N 118.371 0.532 . . . . 0.0 110.388 -179.293 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 34.4 tptt -68.81 -38.99 80.29 Favored 'General case' 0 CA--C 1.528 0.129 0 CA-C-N 118.865 0.757 . . . . 0.0 111.088 -179.631 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 34' ' ' ALA . . . . . . . . . . . . . . . -65.81 -36.25 82.97 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-O 122.577 1.18 . . . . 0.0 109.348 178.825 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 20.6 tt0 -75.7 -19.39 59.14 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 124.137 0.975 . . . . 0.0 110.294 179.433 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 36' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -86.19 -45.55 11.22 Favored 'General case' 0 C--O 1.232 0.169 0 C-N-CA 125.561 1.544 . . . . 0.0 109.856 179.109 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 37' ' ' SER . . . . . . . . . . . . . 48.0 t -79.16 -10.96 59.96 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-O 118.787 -0.625 . . . . 0.0 109.914 -179.911 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 82.39 -7.69 63.75 Favored Glycine 0 C--N 1.338 0.685 0 C-N-CA 124.975 1.274 . . . . 0.0 115.165 178.227 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 39' ' ' LEU . . . . . . . . . . . . . 13.8 mt -96.44 125.48 40.96 Favored 'General case' 0 CA--C 1.518 -0.253 0 CA-C-N 120.235 2.017 . . . . 0.0 105.85 -179.519 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 40' ' ' THR . . . . . . . . . . . . . 5.3 t -45.85 151.32 0.46 Allowed 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 125.202 1.401 . . . . 0.0 110.497 179.851 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 41' ' ' VAL . . . . . . . . . . . . . 53.3 t -45.73 -46.41 4.93 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.218 0 C-N-CA 125.307 1.443 . . . . 0.0 111.772 -179.047 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 42' ' ' SER . . . . . . . . . . . . . 9.6 p -55.55 -45.38 77.27 Favored 'General case' 0 C--O 1.235 0.291 0 O-C-N 121.747 -0.596 . . . . 0.0 112.188 -179.967 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -70.23 -46.74 63.86 Favored 'General case' 0 C--O 1.222 -0.391 0 C-N-CA 124.582 1.153 . . . . 0.0 108.854 178.936 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 44' ' ' TYR . . . . . . . . . . . . . 38.8 t80 -49.61 -50.58 42.23 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 124.626 1.17 . . . . 0.0 109.08 179.662 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 45' ' ' ILE . . . . . 0.411 HG23 HG23 ' A' ' 45' ' ' ILE . 21.6 mm -54.44 -61.19 1.04 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.421 0 C-N-CA 124.085 0.954 . . . . 0.0 111.395 179.457 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 46' ' ' ARG . . . . . . . . . . . . . 12.1 ptm180 -59.91 -43.97 94.56 Favored 'General case' 0 N--CA 1.467 0.396 0 O-C-N 121.736 -0.602 . . . . 0.0 111.704 -178.766 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 47' ' ' ASN . . . . . . . . . . . . . 20.6 t30 -56.95 -57.16 13.73 Favored 'General case' 0 N--CA 1.449 -0.509 0 C-N-CA 124.392 1.077 . . . . 0.0 110.76 -179.113 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -61.95 -33.41 74.23 Favored 'General case' 0 N--CA 1.453 -0.281 0 C-N-CA 124.404 1.081 . . . . 0.0 111.708 -179.968 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 49' ' ' ALA . . . . . . . . . . . . . . . -68.56 -42.24 78.64 Favored 'General case' 0 N--CA 1.451 -0.376 0 O-C-N 121.703 -0.623 . . . . 0.0 112.114 -179.11 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 12.5 mt -80.46 -36.03 34.08 Favored 'General case' 0 C--N 1.328 -0.362 0 C-N-CA 123.115 0.566 . . . . 0.0 112.061 -178.844 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 51' ' ' ASN . . . . . . . . . . . . . 46.7 m-80 . . . . . 0 C--O 1.248 1.0 0 CA-C-O 117.362 -1.304 . . . . 0.0 109.769 -179.077 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 14.6 t . . . . . 0 N--CA 1.446 -0.674 0 N-CA-C 107.048 -1.464 . . . . 0.0 107.048 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 36.2 t -119.56 129.31 75.49 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.672 0 N-CA-C 104.108 -2.553 . . . . 0.0 104.108 178.92 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 14.3 p -122.0 98.97 6.35 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.515 0 N-CA-C 102.842 -3.021 . . . . 0.0 102.842 178.202 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 62.4 mtt-85 -140.42 164.9 28.88 Favored 'General case' 0 CA--C 1.51 -0.565 0 CA-C-N 115.021 -0.99 . . . . 0.0 110.119 -179.279 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -110.39 148.76 31.37 Favored 'General case' 0 N--CA 1.444 -0.73 0 C-N-CA 125.216 1.406 . . . . 0.0 107.615 179.272 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 58.2 mt -145.09 112.87 6.33 Favored 'General case' 0 CA--C 1.51 -0.558 0 N-CA-C 107.228 -1.397 . . . . 0.0 107.228 178.749 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 14.8 mtm180 -86.42 152.17 22.92 Favored 'General case' 0 C--O 1.238 0.492 0 N-CA-C 107.416 -1.327 . . . . 0.0 107.416 178.052 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 87.7 m-85 -132.8 140.08 47.83 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 105.415 -2.069 . . . . 0.0 105.415 179.58 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -66.76 173.15 2.66 Favored Pre-proline 0 CA--C 1.552 1.037 0 CA-C-N 119.324 0.965 . . . . 0.0 109.53 -179.841 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 28.9 Cg_endo -63.44 -42.29 22.42 Favored 'Trans proline' 0 C--N 1.348 0.517 0 C-N-CA 121.845 1.697 . . . . 0.0 112.983 -178.029 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 38.4 t -67.11 -40.05 84.51 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.306 0 C-N-CA 123.613 0.765 . . . . 0.0 109.653 -179.995 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 -66.26 -44.18 84.35 Favored 'General case' 0 CA--C 1.521 -0.171 0 C-N-CA 124.94 1.296 . . . . 0.0 111.089 -178.791 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 34.5 t70 -61.88 -49.11 77.54 Favored 'General case' 0 CA--C 1.502 -0.89 0 N-CA-C 108.289 -1.004 . . . . 0.0 108.289 179.22 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 44.8 tt0 -52.52 -43.77 65.33 Favored 'General case' 0 N--CA 1.445 -0.714 0 CA-C-O 118.325 -0.845 . . . . 0.0 110.941 179.945 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 32.4 m -65.92 -54.92 20.15 Favored 'General case' 0 CA--C 1.529 0.154 0 CA-C-N 118.837 0.744 . . . . 0.0 109.631 179.185 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 79.9 mt -63.11 -25.6 38.92 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.325 0 CA-C-O 121.724 0.773 . . . . 0.0 111.784 -178.661 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 42.2 ttt180 -77.84 -45.46 24.26 Favored 'General case' 0 C--N 1.316 -0.882 0 O-C-N 119.826 -1.796 . . . . 0.0 107.582 179.526 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 5.6 mptt -68.47 -47.28 67.53 Favored 'General case' 0 CA--C 1.519 -0.22 0 CA-C-O 118.167 -0.92 . . . . 0.0 112.78 179.879 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 29.3 tptt -67.97 -33.67 75.09 Favored 'General case' 0 CA--C 1.523 -0.081 0 CA-C-N 120.407 1.458 . . . . 0.0 111.746 -177.941 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -67.13 -54.88 17.17 Favored 'General case' 0 C--N 1.331 -0.207 0 C-N-CA 125.249 1.42 . . . . 0.0 108.212 179.599 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 22.7 tt0 -60.13 -39.99 88.22 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-N 115.48 -0.782 . . . . 0.0 111.213 -179.143 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -64.95 -41.25 95.66 Favored 'General case' 0 N--CA 1.462 0.126 0 C-N-CA 124.857 1.263 . . . . 0.0 109.984 179.111 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 35.7 m -79.57 -9.05 59.56 Favored 'General case' 0 N--CA 1.448 -0.574 0 C-N-CA 123.741 0.817 . . . . 0.0 112.706 -179.388 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 75.15 13.56 82.63 Favored Glycine 0 CA--C 1.531 1.045 0 CA-C-N 119.377 0.99 . . . . 0.0 113.508 -179.972 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 13.0 mt -115.77 116.43 28.03 Favored 'General case' 0 CA--C 1.511 -0.549 0 N-CA-C 104.379 -2.452 . . . . 0.0 104.379 179.047 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 9.9 t -53.47 157.39 2.11 Favored 'General case' 0 CA--C 1.537 0.449 0 N-CA-C 109.486 -0.561 . . . . 0.0 109.486 179.062 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 61.0 t -45.62 -43.86 4.08 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.206 0 C-N-CA 125.223 1.409 . . . . 0.0 111.551 -179.457 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 97.7 p -59.68 -50.36 74.16 Favored 'General case' 0 CA--C 1.545 0.752 0 CA-C-N 119.44 1.018 . . . . 0.0 111.206 -179.42 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.5 -42.55 98.5 Favored 'General case' 0 C--N 1.339 0.126 0 C-N-CA 124.302 1.041 . . . . 0.0 109.743 179.161 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 67.9 t80 -57.46 -53.33 59.42 Favored 'General case' 0 N--CA 1.45 -0.467 0 N-CA-C 109.335 -0.617 . . . . 0.0 109.335 179.211 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 23.3 mm -54.13 -54.83 17.84 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.152 0 C-N-CA 124.269 1.027 . . . . 0.0 111.372 -179.292 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 13.2 ptt180 -60.78 -50.84 71.83 Favored 'General case' 0 N--CA 1.464 0.266 0 O-C-N 121.609 -0.682 . . . . 0.0 111.397 -179.615 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 22.9 t30 -55.41 -58.37 8.04 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 118.667 -0.682 . . . . 0.0 110.463 -179.562 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -57.14 -31.97 65.89 Favored 'General case' 0 N--CA 1.456 -0.138 0 C-N-CA 124.106 0.963 . . . . 0.0 113.297 -178.934 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -79.81 -33.21 40.61 Favored 'General case' 0 CA--C 1.531 0.248 0 N-CA-C 114.396 1.258 . . . . 0.0 114.396 -179.18 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 13.8 mt -82.98 -33.42 26.62 Favored 'General case' 0 N--CA 1.47 0.53 0 CA-C-N 118.5 0.591 . . . . 0.0 111.316 -178.988 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 3.4 m-80 . . . . . 0 C--O 1.249 1.028 0 C-N-CA 124.646 1.179 . . . . 0.0 108.335 179.107 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 12.4 t . . . . . 0 N--CA 1.441 -0.883 0 N-CA-C 107.35 -1.352 . . . . 0.0 107.35 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 21.1 t -138.11 152.85 26.32 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.516 0 N-CA-C 106.762 -1.57 . . . . 0.0 106.762 -179.905 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 9.8 p -141.62 104.19 1.3 Allowed 'Isoleucine or valine' 0 N--CA 1.441 -0.891 0 N-CA-C 104.46 -2.422 . . . . 0.0 104.46 177.795 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 30.2 mtt-85 -149.66 152.98 36.28 Favored 'General case' 0 CA--C 1.517 -0.31 0 O-C-N 121.708 -0.62 . . . . 0.0 110.636 -179.323 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 2.3 m -100.36 145.13 28.54 Favored 'General case' 0 C--N 1.327 -0.412 0 C-N-CA 124.909 1.283 . . . . 0.0 108.584 -179.515 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 61.3 mt -134.79 112.84 11.05 Favored 'General case' 0 CA--C 1.52 -0.183 0 N-CA-C 107.699 -1.223 . . . . 0.0 107.699 178.871 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 21.8 mmm-85 -82.52 118.16 23.05 Favored 'General case' 0 C--O 1.233 0.234 0 C-N-CA 124.56 1.144 . . . . 0.0 108.747 179.706 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 22' ' ' PHE . . . . . . . . . . . . . 96.7 m-85 -113.55 155.71 24.92 Favored 'General case' 0 N--CA 1.475 0.808 0 CA-C-N 119.725 1.148 . . . . 0.0 108.421 179.427 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -85.91 168.17 20.75 Favored Pre-proline 0 CA--C 1.541 0.619 0 N-CA-C 107.607 -1.257 . . . . 0.0 107.607 179.509 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 24' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_endo -62.77 -33.21 77.08 Favored 'Trans proline' 0 N--CA 1.459 -0.504 0 C-N-CA 121.611 1.54 . . . . 0.0 112.868 -178.835 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 25' ' ' VAL . . . . . . . . . . . . . 26.3 t -68.25 -57.0 10.57 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.187 0 C-N-CA 124.154 0.982 . . . . 0.0 108.907 179.566 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 2.4 mp0 -55.29 -42.5 73.7 Favored 'General case' 0 CA--C 1.529 0.143 0 C-N-CA 123.568 0.747 . . . . 0.0 110.972 -179.703 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 27' ' ' ASP . . . . . . . . . . . . . 5.0 t70 -63.47 -44.66 93.79 Favored 'General case' 0 C--O 1.224 -0.282 0 C-N-CA 123.476 0.71 . . . . 0.0 109.956 178.776 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 28' ' ' GLU . . . . . . . . . . . . . 19.1 tt0 -58.5 -49.06 78.75 Favored 'General case' 0 N--CA 1.45 -0.464 0 N-CA-C 109.285 -0.635 . . . . 0.0 109.285 179.762 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 88.4 m -58.9 -54.68 44.34 Favored 'General case' 0 N--CA 1.452 -0.362 0 C-N-CA 124.835 1.254 . . . . 0.0 109.686 179.816 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 63.8 mt -59.59 -44.98 94.49 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.132 0 CA-C-N 118.302 0.501 . . . . 0.0 110.461 -179.54 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 77.0 ttt180 -59.08 -47.86 83.71 Favored 'General case' 0 C--O 1.235 0.32 0 C-N-CA 123.4 0.68 . . . . 0.0 110.75 -179.14 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 9.2 mptt -62.85 -50.44 70.93 Favored 'General case' 0 CA--C 1.512 -0.494 0 O-C-N 123.812 0.695 . . . . 0.0 109.621 179.27 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 9.1 tptt -62.23 -38.83 90.71 Favored 'General case' 0 CA--C 1.516 -0.349 0 CA-C-O 118.609 -0.71 . . . . 0.0 112.322 -177.858 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 34' ' ' ALA . . . . . . . . . . . . . . . -58.47 -52.73 64.38 Favored 'General case' 0 N--CA 1.45 -0.439 0 N-CA-C 108.251 -1.018 . . . . 0.0 108.251 178.47 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 11.7 tt0 -68.01 -34.98 77.53 Favored 'General case' 0 CA--C 1.533 0.322 0 N-CA-C 113.003 0.742 . . . . 0.0 113.003 -178.853 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 36' ' ' ASP . . . . . . . . . . . . . 30.3 t70 -65.03 -40.78 95.35 Favored 'General case' 0 C--N 1.332 -0.18 0 C-N-CA 125.122 1.369 . . . . 0.0 108.847 179.389 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 37' ' ' SER . . . . . . . . . . . . . 72.4 m -79.77 -12.89 59.76 Favored 'General case' 0 N--CA 1.45 -0.435 0 C-N-CA 123.09 0.556 . . . . 0.0 110.58 178.459 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 79.07 23.55 63.39 Favored Glycine 0 CA--C 1.523 0.589 0 CA-C-O 118.219 -1.323 . . . . 0.0 114.716 179.012 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 39' ' ' LEU . . . . . . . . . . . . . 33.4 mt -122.55 147.49 46.32 Favored 'General case' 0 N--CA 1.455 -0.213 0 CA-C-N 119.898 1.849 . . . . 0.0 106.106 179.225 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 40' ' ' THR . . . . . . . . . . . . . 5.5 t -64.31 152.46 41.08 Favored 'General case' 0 C--N 1.324 -0.509 0 O-C-N 120.959 -1.088 . . . . 0.0 108.251 179.298 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 41' ' ' VAL . . . . . . . . . . . . . 42.0 t -49.94 -44.84 21.84 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.353 0 O-C-N 121.242 -0.911 . . . . 0.0 110.691 179.399 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 42' ' ' SER . . . . . . . . . . . . . 3.7 p -59.74 -35.6 74.91 Favored 'General case' 0 CA--C 1.542 0.645 0 O-C-N 121.178 -0.951 . . . . 0.0 111.776 -179.863 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -75.93 -43.16 46.33 Favored 'General case' 0 C--O 1.22 -0.489 0 C-N-CA 124.186 0.994 . . . . 0.0 108.595 178.465 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 44' ' ' TYR . . . . . . . . . . . . . 56.3 t80 -55.54 -48.02 75.38 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 124.098 0.959 . . . . 0.0 108.744 178.927 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 45' ' ' ILE . . . . . . . . . . . . . 26.0 mm -61.32 -55.9 21.47 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.151 0 C-N-CA 123.718 0.807 . . . . 0.0 111.72 179.747 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 46' ' ' ARG . . . . . . . . . . . . . 21.0 ptt180 -59.13 -44.04 92.02 Favored 'General case' 0 C--O 1.222 -0.348 0 CA-C-N 118.863 0.756 . . . . 0.0 109.764 -179.259 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 47' ' ' ASN . . . . . . . . . . . . . 15.3 t30 -56.51 -59.65 4.68 Favored 'General case' 0 N--CA 1.451 -0.399 0 C-N-CA 124.24 1.016 . . . . 0.0 110.714 179.916 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -58.58 -31.58 68.15 Favored 'General case' 0 CA--C 1.529 0.158 0 N-CA-C 113.456 0.91 . . . . 0.0 113.456 -178.767 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 49' ' ' ALA . . . . . . . . . . . . . . . -78.91 -34.7 44.43 Favored 'General case' 0 N--CA 1.452 -0.357 0 N-CA-C 113.773 1.027 . . . . 0.0 113.773 -179.368 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 30.7 mt -81.23 -35.15 31.6 Favored 'General case' 0 C--N 1.329 -0.316 0 O-C-N 121.59 -0.694 . . . . 0.0 112.408 -178.976 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 51' ' ' ASN . . . . . . . . . . . . . 35.7 m-80 . . . . . 0 C--O 1.252 1.221 0 CA-C-O 115.936 -1.983 . . . . 0.0 114.86 -179.329 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 15' ' ' THR . . . . . 0.407 ' HA ' ' O ' ' B' ' 22' ' ' PHE . 2.8 t . . . . . 0 N--CA 1.433 -1.283 0 N-CA-C 109.079 -0.712 . . . . 0.0 109.079 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 16' ' ' VAL . . . . . 0.443 HG21 ' HB2' ' B' ' 27' ' ' ASP . 16.0 t -141.74 150.12 19.59 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.53 0 N-CA-C 104.08 -2.563 . . . . 0.0 104.08 178.161 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 14.6 p -145.19 113.94 1.52 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.491 0 N-CA-C 106.677 -1.601 . . . . 0.0 106.677 178.39 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 60.4 ttt-85 -147.83 161.94 40.25 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 106.783 -1.562 . . . . 0.0 106.783 179.465 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -92.99 133.55 36.02 Favored 'General case' 0 N--CA 1.442 -0.834 0 N-CA-C 104.688 -2.338 . . . . 0.0 104.688 178.056 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.536 HD13 ' H ' ' A' ' 21' ' ' ARG . 0.2 OUTLIER -115.6 159.33 21.44 Favored 'General case' 0 C--O 1.238 0.488 0 N-CA-C 105.673 -1.973 . . . . 0.0 105.673 178.34 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.536 ' H ' HD13 ' A' ' 20' ' ' LEU . 17.4 mmt85 -128.91 150.18 50.47 Favored 'General case' 0 CA--C 1.512 -0.505 0 C-N-CA 124.055 0.942 . . . . 0.0 109.565 -179.759 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 22' ' ' PHE . . . . . 0.464 ' O ' ' HA ' ' B' ' 15' ' ' THR . 90.0 m-85 -142.3 149.83 40.03 Favored 'General case' 0 CA--C 1.515 -0.379 0 N-CA-C 107.568 -1.271 . . . . 0.0 107.568 179.106 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 23' ' ' SER . . . . . 0.488 ' HB3' ' HD2' ' A' ' 24' ' ' PRO . 2.0 m -85.67 -175.62 0.65 Allowed Pre-proline 0 CA--C 1.55 0.965 0 C-N-CA 125.021 1.328 . . . . 0.0 111.091 -179.109 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 24' ' ' PRO . . . . . 0.488 ' HD2' ' HB3' ' A' ' 23' ' ' SER . 39.4 Cg_endo -65.7 -55.06 0.47 Allowed 'Trans proline' 0 C--N 1.357 1.004 0 CA-C-N 121.94 1.729 . . . . 0.0 110.879 -179.485 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 59.9 t -62.0 -40.8 88.61 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.291 0 C-N-CA 123.11 0.564 . . . . 0.0 110.393 -179.772 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -58.46 -50.94 71.92 Favored 'General case' 0 C--O 1.228 -0.051 0 CA-C-N 118.376 0.535 . . . . 0.0 111.597 -179.048 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -65.09 -46.0 82.91 Favored 'General case' 0 CA--C 1.51 -0.563 0 C-N-CA 122.724 0.41 . . . . 0.0 111.311 -179.958 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 39.8 tt0 -54.12 -52.69 60.24 Favored 'General case' 0 N--CA 1.445 -0.708 0 C-N-CA 124.366 1.066 . . . . 0.0 109.69 -179.862 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 22.6 m -63.37 -54.03 43.2 Favored 'General case' 0 N--CA 1.449 -0.493 0 C-N-CA 124.309 1.043 . . . . 0.0 111.034 -179.786 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 34.0 mt -55.55 -44.72 77.46 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.243 0 CA-C-N 118.399 0.545 . . . . 0.0 110.396 -179.331 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 70.1 ttt-85 -62.56 -45.26 93.75 Favored 'General case' 0 C--N 1.33 -0.281 0 C-N-CA 123.179 0.592 . . . . 0.0 110.478 -179.75 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 4.2 mptp? -62.52 -49.21 76.25 Favored 'General case' 0 CA--C 1.517 -0.298 0 C-N-CA 123.085 0.554 . . . . 0.0 109.979 -179.608 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 30.7 tptt -62.12 -50.92 69.97 Favored 'General case' 0 N--CA 1.448 -0.56 0 C-N-CA 122.72 0.408 . . . . 0.0 109.954 -179.331 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -57.0 -47.3 81.15 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 123.824 0.85 . . . . 0.0 111.942 -178.721 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 19.9 tt0 -68.71 -22.46 64.35 Favored 'General case' 0 C--O 1.236 0.394 0 O-C-N 121.147 -0.971 . . . . 0.0 111.018 -179.391 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 24.0 t0 -87.9 -35.73 17.54 Favored 'General case' 0 CA--C 1.522 -0.106 0 C-N-CA 123.635 0.774 . . . . 0.0 110.452 -179.574 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 3.8 t -85.96 -11.43 53.08 Favored 'General case' 0 CA--C 1.536 0.416 0 O-C-N 121.351 -0.843 . . . . 0.0 110.345 179.088 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 86.44 -14.59 54.39 Favored Glycine 0 CA--C 1.527 0.82 0 C-N-CA 125.664 1.602 . . . . 0.0 112.453 -179.669 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 72.2 mt -75.31 112.06 11.21 Favored 'General case' 0 CA--C 1.506 -0.729 0 N-CA-C 105.098 -2.186 . . . . 0.0 105.098 -179.616 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 1.7 t -49.21 152.57 1.15 Allowed 'General case' 0 CA--C 1.538 0.505 0 N-CA-C 108.448 -0.945 . . . . 0.0 108.448 178.645 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 24.3 t -46.5 -35.57 2.61 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.418 0 C-N-CA 125.448 1.499 . . . . 0.0 112.063 -179.326 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -70.84 -47.82 57.27 Favored 'General case' 0 CA--C 1.539 0.535 0 O-C-N 121.337 -0.852 . . . . 0.0 110.325 178.058 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -61.75 -43.3 99.12 Favored 'General case' 0 C--O 1.224 -0.243 0 C-N-CA 124.73 1.212 . . . . 0.0 110.126 179.131 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 61.7 t80 -54.41 -52.89 60.32 Favored 'General case' 0 N--CA 1.449 -0.511 0 C-N-CA 125.247 1.419 . . . . 0.0 109.289 179.658 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 45' ' ' ILE . . . . . 0.461 HG23 HG23 ' B' ' 45' ' ' ILE . 20.8 mm -56.55 -60.15 2.22 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.209 0 C-N-CA 123.306 0.642 . . . . 0.0 112.439 179.657 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 11.8 ptm180 -57.27 -44.45 83.96 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-N 118.277 0.49 . . . . 0.0 111.3 -178.775 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 22.8 t30 -57.91 -53.7 55.23 Favored 'General case' 0 N--CA 1.455 -0.221 0 C-N-CA 123.722 0.809 . . . . 0.0 112.019 -179.508 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -62.45 -34.16 76.25 Favored 'General case' 0 C--N 1.334 -0.074 0 N-CA-C 113.017 0.747 . . . . 0.0 113.017 -179.435 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -70.7 -41.82 71.47 Favored 'General case' 0 N--CA 1.448 -0.525 0 N-CA-C 111.971 0.36 . . . . 0.0 111.971 -178.719 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 17.6 mt -74.58 -40.96 61.3 Favored 'General case' 0 CA--C 1.513 -0.452 0 C-N-CA 123.028 0.531 . . . . 0.0 112.098 -178.623 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 43.8 m-80 . . . . . 0 C--O 1.252 1.221 0 O-C-N 124.194 0.934 . . . . 0.0 108.621 179.765 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' B' B ' 15' ' ' THR . . . . . 0.464 ' HA ' ' O ' ' A' ' 22' ' ' PHE . 6.9 t . . . . . 0 N--CA 1.432 -1.327 0 CA-C-O 121.845 0.831 . . . . 0.0 111.077 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 36.1 t -136.67 145.11 30.83 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.426 0 N-CA-C 104.225 -2.509 . . . . 0.0 104.225 178.856 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 12.3 p -130.93 112.57 22.37 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.697 0 N-CA-C 104.938 -2.245 . . . . 0.0 104.938 178.923 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 4.4 ttt-85 -142.84 146.75 34.44 Favored 'General case' 0 CA--C 1.51 -0.584 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.804 -179.646 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 87.4 m -93.34 117.96 30.71 Favored 'General case' 0 C--O 1.239 0.514 0 N-CA-C 104.715 -2.328 . . . . 0.0 104.715 178.391 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 14.6 tp -120.38 138.54 53.69 Favored 'General case' 0 C--O 1.236 0.395 0 C-N-CA 124.434 1.094 . . . . 0.0 108.869 -178.742 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 11.2 mtt85 -116.15 161.32 19.11 Favored 'General case' 0 CA--C 1.519 -0.24 0 C-N-CA 124.142 0.977 . . . . 0.0 111.562 -179.177 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 22' ' ' PHE . . . . . 0.407 ' O ' ' HA ' ' A' ' 15' ' ' THR . 82.1 m-85 -143.83 157.64 44.23 Favored 'General case' 0 C--N 1.33 -0.258 0 C-N-CA 125.298 1.439 . . . . 0.0 108.019 -179.839 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 50.3 m -79.94 170.44 15.84 Favored Pre-proline 0 CA--C 1.548 0.89 0 C-N-CA 125.241 1.416 . . . . 0.0 107.369 178.344 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 24' ' ' PRO . . . . . . . . . . . . . 60.8 Cg_endo -69.12 -42.82 3.68 Favored 'Trans proline' 0 C--N 1.347 0.448 0 CA-C-N 121.345 1.516 . . . . 0.0 111.063 -178.868 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 25' ' ' VAL . . . . . . . . . . . . . 4.2 t -60.84 -39.16 80.97 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.475 0 C-N-CA 124.013 0.925 . . . . 0.0 108.916 179.762 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 81.3 mt-10 -69.46 -49.78 51.75 Favored 'General case' 0 C--O 1.22 -0.497 0 C-N-CA 123.55 0.74 . . . . 0.0 109.783 179.685 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 27' ' ' ASP . . . . . 0.443 ' HB2' HG21 ' A' ' 16' ' ' VAL . 2.6 t70 -56.09 -43.29 77.9 Favored 'General case' 0 CA--C 1.513 -0.448 0 C-N-CA 124.559 1.144 . . . . 0.0 111.477 179.635 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 28' ' ' GLU . . . . . . . . . . . . . 34.8 tt0 -65.09 -50.44 66.1 Favored 'General case' 0 N--CA 1.445 -0.724 0 O-C-N 123.927 0.767 . . . . 0.0 108.946 179.773 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 60.5 m -58.68 -51.78 68.48 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 122.979 0.512 . . . . 0.0 109.66 179.692 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 83.9 mt -58.45 -43.8 87.5 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.23 0 C-N-CA 124.337 1.055 . . . . 0.0 109.546 -179.803 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 64.9 ttt180 -62.82 -49.57 74.41 Favored 'General case' 0 CA--C 1.519 -0.223 0 O-C-N 121.587 -0.695 . . . . 0.0 110.005 179.737 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 5.1 mptp? -62.28 -42.99 99.82 Favored 'General case' 0 N--CA 1.454 -0.242 0 CA-C-O 118.044 -0.979 . . . . 0.0 110.408 -179.741 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 33' ' ' LYS . . . . . 0.433 ' HD2' ' HA ' ' B' ' 33' ' ' LYS . 34.7 tptt -70.37 -37.74 74.63 Favored 'General case' 0 CA--C 1.521 -0.135 0 CA-C-N 119.715 1.143 . . . . 0.0 111.369 -179.413 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 34' ' ' ALA . . . . . . . . . . . . . . . -60.82 -49.12 78.76 Favored 'General case' 0 N--CA 1.453 -0.303 0 N-CA-C 107.259 -1.385 . . . . 0.0 107.259 177.999 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 67.9 tt0 -60.7 -44.64 96.32 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 124.233 1.013 . . . . 0.0 110.863 179.85 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 36' ' ' ASP . . . . . . . . . . . . . 20.8 t70 -62.19 -41.73 98.61 Favored 'General case' 0 CA--C 1.519 -0.214 0 C-N-CA 126.781 2.033 . . . . 0.0 110.19 -179.436 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 37' ' ' SER . . . . . . . . . . . . . 8.0 t -82.16 -10.44 59.17 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 123.058 0.543 . . . . 0.0 111.159 179.527 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 71.41 10.95 71.24 Favored Glycine 0 CA--C 1.533 1.17 0 O-C-N 120.776 -1.203 . . . . 0.0 111.302 -178.761 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 39' ' ' LEU . . . . . . . . . . . . . 27.2 mt -107.07 112.63 25.64 Favored 'General case' 0 N--CA 1.451 -0.399 0 C-N-CA 126.486 1.914 . . . . 0.0 106.173 -179.93 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 40' ' ' THR . . . . . . . . . . . . . 6.4 t -45.51 153.78 0.23 Allowed 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 125.957 1.703 . . . . 0.0 110.156 179.476 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 41' ' ' VAL . . . . . . . . . . . . . 89.4 t -45.62 -45.41 4.49 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.246 0 C-N-CA 124.621 1.168 . . . . 0.0 111.686 -178.683 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 42' ' ' SER . . . . . . . . . . . . . 4.3 p -63.64 -42.92 98.09 Favored 'General case' 0 CA--C 1.541 0.628 0 O-C-N 121.117 -0.989 . . . . 0.0 112.063 179.597 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -65.26 -43.42 91.36 Favored 'General case' 0 C--N 1.34 0.157 0 C-N-CA 125.03 1.332 . . . . 0.0 109.193 178.956 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 44' ' ' TYR . . . . . . . . . . . . . 84.8 t80 -58.1 -52.28 66.21 Favored 'General case' 0 N--CA 1.448 -0.527 0 C-N-CA 125.26 1.424 . . . . 0.0 108.497 179.298 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 45' ' ' ILE . . . . . 0.461 HG23 HG23 ' A' ' 45' ' ' ILE . 16.8 mm -57.51 -62.61 0.87 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.393 0 C-N-CA 123.961 0.904 . . . . 0.0 111.261 179.81 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 46' ' ' ARG . . . . . . . . . . . . . 9.0 ptm180 -53.59 -41.17 66.31 Favored 'General case' 0 C--O 1.224 -0.287 0 CA-C-O 118.057 -0.973 . . . . 0.0 112.558 -178.664 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 47' ' ' ASN . . . . . . . . . . . . . 16.1 t30 -70.62 -52.2 22.96 Favored 'General case' 0 N--CA 1.453 -0.321 0 C-N-CA 124.502 1.121 . . . . 0.0 111.187 -179.348 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -58.4 -31.45 67.71 Favored 'General case' 0 CA--C 1.53 0.178 0 C-N-CA 122.908 0.483 . . . . 0.0 112.016 -179.175 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 49' ' ' ALA . . . . . . . . . . . . . . . -74.83 -21.05 59.5 Favored 'General case' 0 N--CA 1.445 -0.686 0 N-CA-C 114.761 1.393 . . . . 0.0 114.761 -179.476 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 10.8 mt -105.38 -34.84 7.71 Favored 'General case' 0 N--CA 1.469 0.52 0 N-CA-C 113.757 1.021 . . . . 0.0 113.757 -178.391 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 51' ' ' ASN . . . . . . . . . . . . . 26.3 m-80 . . . . . 0 C--O 1.252 1.232 0 CA-C-O 116.214 -1.85 . . . . 0.0 113.528 -178.307 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 11.4 t . . . . . 0 N--CA 1.439 -1.025 0 N-CA-C 107.305 -1.369 . . . . 0.0 107.305 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 2.3 p -80.2 148.8 5.49 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.01 0 N-CA-C 105.515 -2.032 . . . . 0.0 105.515 178.245 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 13.1 p -144.81 114.0 1.68 Allowed 'Isoleucine or valine' 0 N--CA 1.441 -0.914 0 N-CA-C 107.541 -1.281 . . . . 0.0 107.541 177.692 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 17.0 ttt85 -145.47 177.72 8.64 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 106.57 -1.641 . . . . 0.0 106.57 178.951 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 29.5 m -128.35 139.69 52.25 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 104.346 -2.464 . . . . 0.0 104.346 179.156 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 77.8 mt -120.16 169.08 10.57 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-N 118.626 0.648 . . . . 0.0 109.764 179.605 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 12.3 mmt-85 -137.81 136.09 36.89 Favored 'General case' 0 C--O 1.237 0.397 0 C-N-CA 126.281 1.832 . . . . 0.0 109.38 -179.975 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 22' ' ' PHE . . . . . 0.41 ' H ' HG13 ' B' ' 16' ' ' VAL . 24.6 m-85 -133.95 152.58 51.91 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 106.715 -1.587 . . . . 0.0 106.715 178.76 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 4.9 m -69.04 166.93 23.43 Favored Pre-proline 0 CA--C 1.543 0.681 0 N-CA-C 107.734 -1.21 . . . . 0.0 107.734 178.929 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 19.5 Cg_endo -56.84 -48.62 17.66 Favored 'Trans proline' 0 N--CA 1.461 -0.425 0 C-N-CA 121.801 1.667 . . . . 0.0 112.21 -178.975 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 98.0 t -59.94 -43.67 92.81 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.471 0 C-N-CA 126.171 1.788 . . . . 0.0 110.722 179.861 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 88.0 mt-10 -67.39 -46.05 74.43 Favored 'General case' 0 C--N 1.334 -0.076 0 C-N-CA 124.991 1.316 . . . . 0.0 110.7 -178.827 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 30.5 t70 -62.4 -42.11 99.18 Favored 'General case' 0 CA--C 1.519 -0.213 0 N-CA-C 109.12 -0.696 . . . . 0.0 109.12 179.443 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 16.5 tt0 -66.28 -37.03 84.5 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 124.298 1.039 . . . . 0.0 109.79 178.883 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 95.3 m -64.35 -55.05 23.8 Favored 'General case' 0 CA--C 1.531 0.224 0 N-CA-C 106.949 -1.5 . . . . 0.0 106.949 178.68 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 75.1 mt -56.46 -45.68 81.95 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.247 0 C-N-CA 124.219 1.008 . . . . 0.0 108.987 -179.882 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 74.6 ttt180 -59.95 -47.54 85.38 Favored 'General case' 0 N--CA 1.457 -0.091 0 C-N-CA 123.511 0.724 . . . . 0.0 110.966 -179.785 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 11.7 mptt -64.02 -48.73 75.16 Favored 'General case' 0 CA--C 1.522 -0.109 0 CA-C-O 118.15 -0.928 . . . . 0.0 110.647 -179.792 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 24.9 mmtp -60.6 -46.12 91.42 Favored 'General case' 0 N--CA 1.463 0.213 0 CA-C-N 119.019 0.827 . . . . 0.0 109.915 -179.539 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -56.93 -55.28 36.63 Favored 'General case' 0 N--CA 1.454 -0.23 0 C-N-CA 124.013 0.925 . . . . 0.0 110.286 179.787 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 27.5 tt0 -64.43 -35.07 79.72 Favored 'General case' 0 N--CA 1.455 -0.21 0 CA-C-O 119.072 -0.49 . . . . 0.0 112.193 -178.761 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 41.8 t0 -66.21 -39.74 89.85 Favored 'General case' 0 N--CA 1.466 0.325 0 N-CA-C 107.838 -1.171 . . . . 0.0 107.838 179.484 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 22.9 t -75.57 -10.63 59.61 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 125.482 1.513 . . . . 0.0 110.211 178.374 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 73.06 4.15 62.3 Favored Glycine 0 CA--C 1.531 1.068 0 C-N-CA 125.551 1.548 . . . . 0.0 113.962 -179.984 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 12.9 mt -106.34 128.03 53.7 Favored 'General case' 0 CA--C 1.51 -0.584 0 N-CA-C 105.414 -2.069 . . . . 0.0 105.414 179.749 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 8.7 t -50.82 152.43 2.1 Favored 'General case' 0 CA--C 1.539 0.546 0 CA-C-O 121.435 0.636 . . . . 0.0 110.571 179.256 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 52.0 t -46.63 -40.49 4.55 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.166 0 C-N-CA 126.089 1.756 . . . . 0.0 111.908 -179.78 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 3.5 p -61.46 -42.58 99.0 Favored 'General case' 0 CA--C 1.535 0.365 0 CA-C-N 119.567 1.076 . . . . 0.0 111.37 -179.732 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -70.65 -42.13 71.23 Favored 'General case' 0 C--O 1.222 -0.391 0 N-CA-C 108.527 -0.916 . . . . 0.0 108.527 178.343 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 56.0 t80 -55.08 -51.5 66.19 Favored 'General case' 0 CA--C 1.535 0.396 0 CA-C-N 118.838 0.745 . . . . 0.0 109.083 179.235 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 18.1 mm -56.83 -61.44 1.23 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.19 0 C-N-CA 125.173 1.389 . . . . 0.0 110.207 179.686 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 11.8 ptt180 -51.58 -44.3 62.73 Favored 'General case' 0 C--O 1.222 -0.377 0 C-N-CA 123.655 0.782 . . . . 0.0 110.738 -179.135 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 2.2 t30 -62.07 -56.85 14.81 Favored 'General case' 0 N--CA 1.452 -0.338 0 C-N-CA 123.882 0.873 . . . . 0.0 110.031 179.016 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -59.12 -32.05 69.49 Favored 'General case' 0 C--O 1.224 -0.256 0 N-CA-C 113.521 0.934 . . . . 0.0 113.521 -178.645 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -76.28 -24.5 54.45 Favored 'General case' 0 CA--C 1.533 0.322 0 N-CA-C 113.696 0.999 . . . . 0.0 113.696 -179.485 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 17.9 mt -97.46 -28.3 14.05 Favored 'General case' 0 N--CA 1.466 0.339 0 C-N-CA 123.18 0.592 . . . . 0.0 110.288 179.62 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 43.1 m-80 . . . . . 0 C--O 1.253 1.276 0 C-N-CA 125.521 1.528 . . . . 0.0 108.335 179.133 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 5.5 t . . . . . 0 N--CA 1.443 -0.8 0 CA-C-O 123.986 1.85 . . . . 0.0 110.711 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' B' B ' 16' ' ' VAL . . . . . 0.41 HG13 ' H ' ' A' ' 22' ' ' PHE . 0.3 OUTLIER -130.24 148.46 33.16 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.794 0 N-CA-C 102.209 -3.256 . . . . 0.0 102.209 178.316 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 9.3 p -147.08 98.79 0.41 Allowed 'Isoleucine or valine' 0 N--CA 1.436 -1.173 0 N-CA-C 104.559 -2.386 . . . . 0.0 104.559 179.201 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 16.8 ttt85 -138.74 152.37 47.91 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.105 -0.952 . . . . 0.0 110.945 -179.265 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 19.6 m -91.73 135.89 33.56 Favored 'General case' 0 C--N 1.326 -0.435 0 C-N-CA 125.316 1.446 . . . . 0.0 108.195 179.92 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 20' ' ' LEU . . . . . 0.403 HD23 ' CZ ' ' B' ' 22' ' ' PHE . 0.2 OUTLIER -139.09 134.82 33.43 Favored 'General case' 0 C--O 1.237 0.407 0 N-CA-C 108.84 -0.8 . . . . 0.0 108.84 179.085 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 50.1 mtm-85 -115.67 159.1 21.79 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 124.475 1.11 . . . . 0.0 110.798 179.363 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 22' ' ' PHE . . . . . 0.403 ' CZ ' HD23 ' B' ' 20' ' ' LEU . 31.9 m-85 -145.43 154.24 42.04 Favored 'General case' 0 C--O 1.238 0.45 0 C-N-CA 125.398 1.479 . . . . 0.0 108.18 179.98 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 15.4 m -67.85 168.01 14.55 Favored Pre-proline 0 CA--C 1.537 0.46 0 N-CA-C 108.568 -0.901 . . . . 0.0 108.568 178.82 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 24' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -63.09 -42.19 24.6 Favored 'Trans proline' 0 N--CA 1.457 -0.63 0 CA-C-N 120.291 1.14 . . . . 0.0 109.329 179.356 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 25' ' ' VAL . . . . . . . . . . . . . 75.6 t -57.07 -44.75 83.53 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.585 0 C-N-CA 123.797 0.839 . . . . 0.0 109.637 178.925 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 49.3 mt-10 -66.23 -52.19 50.23 Favored 'General case' 0 N--CA 1.454 -0.23 0 C-N-CA 124.355 1.062 . . . . 0.0 110.392 -179.785 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 27' ' ' ASP . . . . . . . . . . . . . 34.9 t70 -60.27 -39.81 88.16 Favored 'General case' 0 C--O 1.223 -0.295 0 C-N-CA 123.692 0.797 . . . . 0.0 111.471 -179.237 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 28' ' ' GLU . . . . . . . . . . . . . 79.6 mt-10 -63.92 -50.91 66.85 Favored 'General case' 0 N--CA 1.453 -0.311 0 N-CA-C 107.616 -1.253 . . . . 0.0 107.616 178.506 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 90.2 m -55.1 -58.96 5.53 Favored 'General case' 0 CA--C 1.531 0.219 0 N-CA-C 109.104 -0.702 . . . . 0.0 109.104 179.618 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 92.9 mt -55.06 -47.03 77.53 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.353 0 C-N-CA 124.29 1.036 . . . . 0.0 110.132 -179.286 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 61.7 ttt180 -58.9 -48.83 80.05 Favored 'General case' 0 CA--C 1.52 -0.207 0 CA-C-N 119.093 0.861 . . . . 0.0 110.542 -179.752 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 10.6 mptt -61.7 -49.18 77.49 Favored 'General case' 0 C--O 1.22 -0.466 0 CA-C-O 118.546 -0.74 . . . . 0.0 109.889 -179.248 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 22.8 mmtp -56.71 -49.79 74.1 Favored 'General case' 0 CA--C 1.517 -0.319 0 C-N-CA 124.32 1.048 . . . . 0.0 109.574 -178.664 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 34' ' ' ALA . . . . . . . . . . . . . . . -56.19 -58.58 7.36 Favored 'General case' 0 N--CA 1.446 -0.646 0 C-N-CA 125.858 1.663 . . . . 0.0 110.5 179.967 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 11.6 tt0 -67.38 -20.21 65.52 Favored 'General case' 0 N--CA 1.467 0.391 0 N-CA-C 113.599 0.963 . . . . 0.0 113.599 -177.796 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 36' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -92.15 2.96 56.27 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 126.401 1.88 . . . . 0.0 110.7 178.884 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 37' ' ' SER . . . . . . . . . . . . . 18.6 t -122.59 -6.35 8.65 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 125.779 1.632 . . . . 0.0 111.021 -179.921 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 73.87 31.5 60.07 Favored Glycine 0 CA--C 1.527 0.783 0 N-CA-C 110.176 -1.169 . . . . 0.0 110.176 -179.455 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 39' ' ' LEU . . . . . . . . . . . . . 59.6 mt -128.19 129.56 46.66 Favored 'General case' 0 N--CA 1.446 -0.637 0 C-N-CA 125.959 1.704 . . . . 0.0 108.83 -178.491 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 40' ' ' THR . . . . . . . . . . . . . 1.8 t -66.59 152.4 45.37 Favored 'General case' 0 CA--C 1.541 0.611 0 N-CA-C 104.344 -2.465 . . . . 0.0 104.344 176.626 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 41' ' ' VAL . . . . . . . . . . . . . 55.0 t -47.58 -40.94 7.6 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.338 0 C-N-CA 124.596 1.158 . . . . 0.0 111.118 179.157 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 42' ' ' SER . . . . . . . . . . . . . 5.1 p -61.77 -44.21 97.33 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-N 120.007 1.276 . . . . 0.0 111.08 179.598 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -65.76 -40.53 92.13 Favored 'General case' 0 C--O 1.226 -0.18 0 C-N-CA 124.008 0.923 . . . . 0.0 109.059 178.776 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 44' ' ' TYR . . . . . . . . . . . . . 53.4 t80 -60.64 -52.64 64.28 Favored 'General case' 0 CA--C 1.534 0.35 0 N-CA-C 108.114 -1.069 . . . . 0.0 108.114 178.904 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 45' ' ' ILE . . . . . . . . . . . . . 23.2 mm -54.53 -62.19 0.8 Allowed 'Isoleucine or valine' 0 C--N 1.34 0.169 0 C-N-CA 124.537 1.135 . . . . 0.0 110.672 -179.888 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 46' ' ' ARG . . . . . . . . . . . . . 22.2 ptt180 -54.75 -47.03 74.34 Favored 'General case' 0 C--O 1.223 -0.291 0 CA-C-O 119.302 -0.38 . . . . 0.0 111.711 -178.856 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 47' ' ' ASN . . . . . . . . . . . . . 23.7 t30 -61.08 -52.04 66.62 Favored 'General case' 0 N--CA 1.448 -0.528 0 CA-C-O 118.282 -0.866 . . . . 0.0 111.132 -178.814 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -63.42 -27.86 69.58 Favored 'General case' 0 C--O 1.225 -0.223 0 C-N-CA 124.038 0.935 . . . . 0.0 112.075 179.776 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 49' ' ' ALA . . . . . . . . . . . . . . . -77.75 -34.8 52.29 Favored 'General case' 0 N--CA 1.457 -0.082 0 O-C-N 121.391 -0.818 . . . . 0.0 111.692 -179.914 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 38.1 mt -82.51 -46.16 13.77 Favored 'General case' 0 C--N 1.33 -0.249 0 C-N-CA 122.874 0.469 . . . . 0.0 110.629 -179.06 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 51' ' ' ASN . . . . . . . . . . . . . 42.5 m-80 . . . . . 0 C--O 1.248 0.981 0 C-N-CA 124.768 1.227 . . . . 0.0 110.668 -179.721 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 4.2 t . . . . . 0 N--CA 1.44 -0.941 0 CA-C-O 122.249 1.023 . . . . 0.0 108.793 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 95.2 t -97.86 145.34 9.66 Favored 'Isoleucine or valine' 0 CA--C 1.505 -0.755 0 C-N-CA 126.747 2.019 . . . . 0.0 105.918 179.308 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 7.8 p -145.62 99.95 0.51 Allowed 'Isoleucine or valine' 0 N--CA 1.441 -0.908 0 CA-C-O 122.6 1.191 . . . . 0.0 108.484 178.066 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 26.4 mtt-85 -143.12 157.39 44.56 Favored 'General case' 0 CA--C 1.511 -0.531 0 CA-C-N 115.084 -0.962 . . . . 0.0 110.234 178.824 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 96.6 m -86.42 100.5 12.39 Favored 'General case' 0 N--CA 1.446 -0.671 0 N-CA-C 106.664 -1.606 . . . . 0.0 106.664 179.548 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -95.4 86.68 4.57 Favored 'General case' 0 C--N 1.323 -0.579 0 C-N-CA 126.806 2.042 . . . . 0.0 107.321 -179.27 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 14.0 mtp180 -77.36 162.51 27.21 Favored 'General case' 0 N--CA 1.453 -0.316 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.64 179.246 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 92.7 m-85 -139.8 171.08 14.73 Favored 'General case' 0 CA--C 1.516 -0.349 0 C-N-CA 125.966 1.707 . . . . 0.0 108.068 178.985 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 7.7 m -106.2 172.56 3.83 Favored Pre-proline 0 CA--C 1.547 0.848 0 N-CA-C 108.063 -1.088 . . . . 0.0 108.063 179.306 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 92.5 Cg_endo -70.67 -33.99 12.27 Favored 'Trans proline' 0 N--CA 1.46 -0.482 0 CA-C-N 122.163 1.808 . . . . 0.0 113.341 -177.545 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 35.7 t -77.31 -36.3 23.77 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.31 0 N-CA-C 107.209 -1.404 . . . . 0.0 107.209 179.187 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 73.9 mt-10 -61.28 -54.1 48.35 Favored 'General case' 0 C--N 1.343 0.285 0 N-CA-C 107.523 -1.288 . . . . 0.0 107.523 178.709 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -57.34 -46.53 83.2 Favored 'General case' 0 C--O 1.217 -0.623 0 C-N-CA 125.068 1.347 . . . . 0.0 111.181 -179.838 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 13.3 tt0 -58.37 -51.38 70.07 Favored 'General case' 0 N--CA 1.452 -0.33 0 CA-C-O 118.726 -0.654 . . . . 0.0 111.204 179.745 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 85.5 m -57.33 -52.5 65.12 Favored 'General case' 0 CA--C 1.536 0.423 0 CA-C-N 118.766 0.712 . . . . 0.0 109.52 179.454 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 96.0 mt -56.89 -47.53 82.94 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.178 0 C-N-CA 123.392 0.677 . . . . 0.0 110.356 -179.299 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 33.1 ttt85 -61.78 -44.83 96.12 Favored 'General case' 0 N--CA 1.448 -0.545 0 C-N-CA 123.875 0.87 . . . . 0.0 111.769 -179.082 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 14.0 mptt -59.17 -51.22 70.95 Favored 'General case' 0 CA--C 1.516 -0.33 0 CA-C-N 118.549 0.613 . . . . 0.0 109.649 179.469 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 4.6 mptp? -62.9 -47.18 84.4 Favored 'General case' 0 CA--C 1.515 -0.379 0 CA-C-O 118.135 -0.936 . . . . 0.0 110.637 -179.01 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -56.15 -55.48 32.6 Favored 'General case' 0 N--CA 1.451 -0.391 0 C-N-CA 124.217 1.007 . . . . 0.0 109.776 179.505 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 5.3 tt0 -60.25 -38.65 84.13 Favored 'General case' 0 C--O 1.234 0.241 0 O-C-N 123.54 0.525 . . . . 0.0 111.545 -178.113 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -72.08 -24.93 61.58 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 123.872 0.869 . . . . 0.0 111.196 179.458 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 2.2 t -83.52 -8.15 59.4 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 126.477 1.911 . . . . 0.0 109.023 178.129 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 77.88 8.66 87.27 Favored Glycine 0 CA--C 1.529 0.957 0 CA-C-O 118.812 -0.994 . . . . 0.0 111.716 -179.029 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 40.1 mt -116.55 154.98 29.47 Favored 'General case' 0 N--CA 1.452 -0.344 0 CA-C-N 119.758 1.779 . . . . 0.0 111.457 -178.435 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 40' ' ' THR . . . . . 0.433 HG22 ' H ' ' A' ' 40' ' ' THR . 0.9 OUTLIER -74.99 151.61 38.78 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 104.116 -2.549 . . . . 0.0 104.116 176.159 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 19.4 m -51.2 -31.29 11.06 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.929 0 CA-C-N 114.873 -1.058 . . . . 0.0 110.937 178.93 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 29.3 t -61.0 -58.94 6.32 Favored 'General case' 0 CA--C 1.536 0.435 0 CA-C-N 119.421 1.009 . . . . 0.0 108.936 178.549 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -58.98 -39.52 82.02 Favored 'General case' 0 C--O 1.223 -0.3 0 C-N-CA 123.662 0.785 . . . . 0.0 109.385 178.78 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 77.8 t80 -60.78 -50.19 74.45 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-O 119.084 -0.484 . . . . 0.0 109.737 179.059 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 10.8 mm -55.6 -62.96 0.66 Allowed 'Isoleucine or valine' 0 N--CA 1.463 0.182 0 C-N-CA 125.272 1.429 . . . . 0.0 109.904 179.99 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 27.3 ptt180 -53.08 -44.09 67.28 Favored 'General case' 0 N--CA 1.454 -0.271 0 C-N-CA 123.293 0.637 . . . . 0.0 110.708 -178.579 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 39.1 t30 -63.2 -55.98 20.5 Favored 'General case' 0 N--CA 1.45 -0.444 0 C-N-CA 123.502 0.721 . . . . 0.0 111.583 -179.798 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -61.35 -28.35 69.16 Favored 'General case' 0 N--CA 1.463 0.223 0 C-N-CA 123.965 0.906 . . . . 0.0 112.096 -178.91 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -74.93 -27.62 60.28 Favored 'General case' 0 N--CA 1.453 -0.281 0 N-CA-C 113.022 0.749 . . . . 0.0 113.022 -179.468 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 13.7 mt -93.83 -44.64 8.02 Favored 'General case' 0 C--N 1.332 -0.193 0 C-N-CA 122.849 0.46 . . . . 0.0 110.747 -179.378 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 79.1 m-20 . . . . . 0 C--O 1.244 0.789 0 C-N-CA 124.622 1.169 . . . . 0.0 111.249 -178.229 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 3.4 t . . . . . 0 N--CA 1.451 -0.378 0 N-CA-C 108.567 -0.901 . . . . 0.0 108.567 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 12.1 t -128.46 115.82 39.29 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.663 0 N-CA-C 103.944 -2.613 . . . . 0.0 103.944 178.954 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 9.0 p -116.74 107.14 21.69 Favored 'Isoleucine or valine' 0 C--O 1.237 0.396 0 CA-C-O 121.957 0.884 . . . . 0.0 110.819 -178.898 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 36.4 mtt180 -133.64 -175.7 3.91 Favored 'General case' 0 C--O 1.239 0.525 0 N-CA-C 108.622 -0.881 . . . . 0.0 108.622 178.189 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 1.9 m -122.34 105.91 10.61 Favored 'General case' 0 N--CA 1.448 -0.555 0 N-CA-C 102.155 -3.276 . . . . 0.0 102.155 178.621 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 15.5 tp -112.27 89.74 3.15 Favored 'General case' 0 N--CA 1.442 -0.836 0 C-N-CA 125.241 1.416 . . . . 0.0 110.454 -177.975 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -63.38 157.42 23.18 Favored 'General case' 0 N--CA 1.452 -0.347 0 C-N-CA 124.614 1.166 . . . . 0.0 110.125 178.177 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 22' ' ' PHE . . . . . . . . . . . . . 88.2 m-85 -138.65 143.63 39.32 Favored 'General case' 0 C--O 1.236 0.389 0 N-CA-C 103.915 -2.624 . . . . 0.0 103.915 177.198 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 23' ' ' SER . . . . . 0.407 ' HB3' ' HD2' ' B' ' 24' ' ' PRO . 3.3 m -73.88 169.41 18.94 Favored Pre-proline 0 C--N 1.32 -0.692 0 C-N-CA 124.204 1.002 . . . . 0.0 109.535 -179.144 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 24' ' ' PRO . . . . . 0.407 ' HD2' ' HB3' ' B' ' 23' ' ' SER . 33.9 Cg_endo -63.25 -43.61 17.93 Favored 'Trans proline' 0 N--CA 1.46 -0.493 0 C-N-CA 121.401 1.401 . . . . 0.0 111.277 -179.371 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 25' ' ' VAL . . . . . . . . . . . . . 24.6 t -66.68 -39.91 84.88 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.298 0 C-N-CA 124.575 1.15 . . . . 0.0 110.313 -179.92 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 83.7 mt-10 -67.13 -44.25 80.34 Favored 'General case' 0 C--N 1.339 0.115 0 N-CA-C 109.359 -0.608 . . . . 0.0 109.359 -179.854 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 27' ' ' ASP . . . . . . . . . . . . . 28.9 t70 -61.3 -44.86 96.51 Favored 'General case' 0 C--O 1.214 -0.783 0 C-N-CA 123.739 0.815 . . . . 0.0 109.131 179.305 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 28' ' ' GLU . . . . . . . . . . . . . 72.7 tt0 -57.64 -52.91 63.51 Favored 'General case' 0 N--CA 1.445 -0.698 0 C-N-CA 125.019 1.328 . . . . 0.0 108.892 178.398 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 96.2 m -60.49 -53.39 58.1 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-N 120.343 1.429 . . . . 0.0 110.36 179.316 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 50.4 mt -55.3 -49.98 68.43 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.272 0 C-N-CA 123.099 0.559 . . . . 0.0 109.761 -179.513 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 31.8 ttt85 -62.09 -43.4 98.92 Favored 'General case' 0 CA--C 1.51 -0.593 0 CA-C-O 117.425 -1.274 . . . . 0.0 110.908 -179.17 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 9.7 mptt -61.11 -48.81 79.95 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 119.85 1.205 . . . . 0.0 109.164 -179.828 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -63.61 -49.34 73.69 Favored 'General case' 0 N--CA 1.455 -0.186 0 CA-C-N 117.988 0.358 . . . . 0.0 110.183 -179.133 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 34' ' ' ALA . . . . . . . . . . . . . . . -56.3 -57.04 13.96 Favored 'General case' 0 N--CA 1.452 -0.326 0 C-N-CA 126.41 1.884 . . . . 0.0 111.069 179.866 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 59.8 tt0 -60.94 -42.65 98.61 Favored 'General case' 0 C--O 1.233 0.202 0 C-N-CA 125.181 1.392 . . . . 0.0 111.286 -178.454 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 36' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -65.52 -40.86 93.44 Favored 'General case' 0 C--N 1.333 -0.134 0 C-N-CA 123.604 0.762 . . . . 0.0 108.957 179.622 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 37' ' ' SER . . . . . . . . . . . . . 9.9 t -77.77 -4.77 48.1 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 124.151 0.981 . . . . 0.0 110.128 178.553 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 63.53 25.9 69.17 Favored Glycine 0 CA--C 1.529 0.948 0 C-N-CA 124.662 1.125 . . . . 0.0 112.912 -179.842 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 39' ' ' LEU . . . . . . . . . . . . . 40.2 mt -119.19 120.94 38.56 Favored 'General case' 0 CA--C 1.507 -0.692 0 N-CA-C 105.439 -2.06 . . . . 0.0 105.439 179.729 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 40' ' ' THR . . . . . . . . . . . . . 12.8 t -53.54 148.87 8.71 Favored 'General case' 0 C--O 1.237 0.407 0 N-CA-C 108.43 -0.952 . . . . 0.0 108.43 178.44 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 41' ' ' VAL . . . . . . . . . . . . . 22.0 m -48.23 -34.3 4.8 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.721 0 CA-C-N 114.79 -1.096 . . . . 0.0 112.142 -179.149 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 42' ' ' SER . . . . . . . . . . . . . 22.9 t -61.27 -49.96 74.96 Favored 'General case' 0 CA--C 1.544 0.744 0 CA-C-N 119.611 1.096 . . . . 0.0 110.143 178.868 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -67.51 -43.42 80.92 Favored 'General case' 0 C--O 1.225 -0.212 0 C-N-CA 123.592 0.757 . . . . 0.0 109.078 178.722 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 44' ' ' TYR . . . . . . . . . . . . . 74.5 t80 -54.58 -50.47 67.92 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 123.163 0.585 . . . . 0.0 109.722 179.529 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 45' ' ' ILE . . . . . . . . . . . . . 12.4 mm -57.28 -64.23 0.55 Allowed 'Isoleucine or valine' 0 C--N 1.341 0.208 0 C-N-CA 125.762 1.625 . . . . 0.0 110.336 179.834 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 46' ' ' ARG . . . . . . . . . . . . . 21.9 ptt180 -53.12 -46.83 68.92 Favored 'General case' 0 C--O 1.222 -0.361 0 CA-C-O 119.148 -0.453 . . . . 0.0 111.06 -178.267 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 47' ' ' ASN . . . . . . . . . . . . . 34.5 t30 -57.76 -51.57 69.04 Favored 'General case' 0 N--CA 1.453 -0.279 0 CA-C-O 118.819 -0.61 . . . . 0.0 111.288 -179.527 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -61.2 -32.77 72.53 Favored 'General case' 0 CA--C 1.53 0.206 0 C-N-CA 123.326 0.651 . . . . 0.0 111.366 -179.899 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 49' ' ' ALA . . . . . . . . . . . . . . . -77.53 -17.72 57.66 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 124.416 1.086 . . . . 0.0 113.729 -179.438 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 22.0 mt -102.84 -37.24 7.94 Favored 'General case' 0 CA--C 1.517 -0.306 0 CA-C-N 118.857 0.753 . . . . 0.0 110.987 -179.546 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 51' ' ' ASN . . . . . . . . . . . . . 7.4 m-80 . . . . . 0 C--O 1.248 1.02 0 C-N-CA 125.302 1.441 . . . . 0.0 107.953 179.704 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 15' ' ' THR . . . . . 0.507 ' CG2' HH11 ' B' ' 21' ' ' ARG . 7.2 t . . . . . 0 N--CA 1.45 -0.446 0 CA-C-O 122.179 0.99 . . . . 0.0 108.861 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 18.0 t -91.85 149.15 4.22 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.724 0 N-CA-C 106.069 -1.826 . . . . 0.0 106.069 178.297 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 10.4 p -139.82 90.62 0.6 Allowed 'Isoleucine or valine' 0 N--CA 1.442 -0.863 0 N-CA-C 104.701 -2.333 . . . . 0.0 104.701 177.321 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 50.6 ttt180 -116.02 170.74 8.26 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 114.519 -1.219 . . . . 0.0 108.645 -179.288 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 10.8 m -117.09 128.34 55.05 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 106.846 -1.539 . . . . 0.0 106.846 179.779 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -125.9 150.47 47.91 Favored 'General case' 0 C--O 1.235 0.31 0 C-N-CA 124.949 1.3 . . . . 0.0 109.235 -179.362 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 68.5 mtt180 -137.8 158.7 43.82 Favored 'General case' 0 N--CA 1.447 -0.587 0 C-N-CA 125.411 1.485 . . . . 0.0 108.232 178.439 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 50.0 m-85 -145.12 156.57 43.96 Favored 'General case' 0 C--O 1.237 0.415 0 N-CA-C 107.84 -1.17 . . . . 0.0 107.84 179.687 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -68.91 168.9 12.92 Favored Pre-proline 0 CA--C 1.543 0.704 0 N-CA-C 107.421 -1.326 . . . . 0.0 107.421 178.7 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 25.3 Cg_endo -61.93 -45.06 17.69 Favored 'Trans proline' 0 N--CA 1.456 -0.702 0 CA-C-N 120.701 1.286 . . . . 0.0 111.264 -178.761 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 72.1 t -65.82 -42.6 92.57 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.29 0 C-N-CA 123.077 0.551 . . . . 0.0 109.908 179.536 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 7.2 mm-40 -60.35 -45.38 93.68 Favored 'General case' 0 CA--C 1.531 0.223 0 C-N-CA 123.307 0.643 . . . . 0.0 109.358 -179.893 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 26.9 t70 -66.59 -44.03 83.29 Favored 'General case' 0 C--O 1.221 -0.416 0 CA-C-O 118.984 -0.532 . . . . 0.0 110.223 179.562 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 31.7 tt0 -58.08 -43.55 87.07 Favored 'General case' 0 CA--C 1.531 0.213 0 C-N-CA 124.758 1.223 . . . . 0.0 109.055 178.976 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 37.4 m -61.22 -50.63 72.31 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 124.283 1.033 . . . . 0.0 108.634 179.273 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 64.7 mt -61.49 -41.34 89.68 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.327 0 N-CA-C 109.262 -0.644 . . . . 0.0 109.262 179.677 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 23.3 ttp85 -60.39 -46.39 90.14 Favored 'General case' 0 N--CA 1.461 0.099 0 C-N-CA 124.003 0.921 . . . . 0.0 109.575 -179.627 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 1.9 mptm? -59.98 -59.04 6.05 Favored 'General case' 0 N--CA 1.45 -0.453 0 C-N-CA 124.993 1.317 . . . . 0.0 110.956 179.537 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 17.5 tptt -60.84 -40.86 94.43 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-O 118.576 -0.726 . . . . 0.0 111.588 -177.479 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -58.45 -51.65 68.94 Favored 'General case' 0 N--CA 1.452 -0.348 0 N-CA-C 108.596 -0.89 . . . . 0.0 108.596 178.813 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 21.8 tt0 -62.17 -41.99 98.84 Favored 'General case' 0 CA--C 1.529 0.157 0 C-N-CA 123.238 0.615 . . . . 0.0 112.093 -179.565 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 38.7 t70 -66.56 -22.88 66.15 Favored 'General case' 0 C--O 1.232 0.167 0 C-N-CA 126.562 1.945 . . . . 0.0 111.281 -179.856 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 10.4 t -97.15 -8.28 30.47 Favored 'General case' 0 N--CA 1.449 -0.523 0 C-N-CA 127.076 2.151 . . . . 0.0 110.994 179.688 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 64.11 31.66 81.59 Favored Glycine 0 CA--C 1.532 1.134 0 O-C-N 120.723 -1.236 . . . . 0.0 111.418 -179.327 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 55.7 mt -127.8 132.54 49.47 Favored 'General case' 0 N--CA 1.448 -0.536 0 N-CA-C 105.2 -2.148 . . . . 0.0 105.2 -179.981 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 8.4 t -61.75 152.76 30.35 Favored 'General case' 0 CA--C 1.538 0.5 0 N-CA-C 107.692 -1.225 . . . . 0.0 107.692 178.679 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 24.1 t -48.33 -41.32 10.8 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.289 0 C-N-CA 124.549 1.14 . . . . 0.0 111.755 -179.974 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 42' ' ' SER . . . . . 0.432 ' HA ' HD21 ' B' ' 20' ' ' LEU . 13.5 p -63.65 -38.25 90.39 Favored 'General case' 0 CA--C 1.532 0.255 0 O-C-N 121.024 -1.048 . . . . 0.0 112.08 179.841 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -69.66 -46.86 65.17 Favored 'General case' 0 C--O 1.222 -0.354 0 N-CA-C 107.607 -1.257 . . . . 0.0 107.607 178.334 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 69.6 t80 -52.87 -46.31 67.85 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 123.973 0.909 . . . . 0.0 110.112 179.152 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 14.8 mm -56.98 -63.57 0.63 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.315 0 C-N-CA 124.044 0.938 . . . . 0.0 110.526 179.429 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 12.4 ptt180 -55.47 -45.16 76.94 Favored 'General case' 0 C--O 1.222 -0.365 0 C-N-CA 123.497 0.719 . . . . 0.0 110.989 -178.55 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 32.2 t30 -58.69 -55.79 30.6 Favored 'General case' 0 N--CA 1.449 -0.521 0 C-N-CA 124.601 1.16 . . . . 0.0 109.065 -179.189 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -61.77 -25.9 67.75 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 123.065 0.546 . . . . 0.0 112.442 179.637 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -79.07 -19.38 51.44 Favored 'General case' 0 CA--C 1.536 0.44 0 N-CA-C 113.341 0.867 . . . . 0.0 113.341 179.523 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 7.9 mt -115.3 -29.03 6.7 Favored 'General case' 0 N--CA 1.466 0.328 0 N-CA-C 114.133 1.16 . . . . 0.0 114.133 -177.966 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 2.0 m-80 . . . . . 0 C--O 1.249 1.048 0 C-N-CA 125.512 1.525 . . . . 0.0 110.3 -178.183 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 7.9 t . . . . . 0 N--CA 1.449 -0.483 0 N-CA-C 106.201 -1.777 . . . . 0.0 106.201 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 9.3 p -109.98 155.99 11.03 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.813 0 N-CA-C 104.619 -2.363 . . . . 0.0 104.619 177.391 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 14.2 p -138.79 122.18 19.3 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.734 0 N-CA-C 106.305 -1.739 . . . . 0.0 106.305 177.964 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 23.8 ttt180 -140.65 159.09 42.97 Favored 'General case' 0 CA--C 1.516 -0.334 0 CA-C-O 122.826 1.298 . . . . 0.0 111.44 179.565 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 1.3 m -108.06 102.47 11.63 Favored 'General case' 0 N--CA 1.445 -0.71 0 N-CA-C 101.294 -3.595 . . . . 0.0 101.294 179.693 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 20' ' ' LEU . . . . . 0.432 HD21 ' HA ' ' A' ' 42' ' ' SER . 0.2 OUTLIER -108.52 120.28 41.98 Favored 'General case' 0 CA--C 1.515 -0.372 0 C-N-CA 124.437 1.095 . . . . 0.0 108.375 -178.504 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' B' B ' 21' ' ' ARG . . . . . 0.507 HH11 ' CG2' ' A' ' 15' ' ' THR . 24.2 mtt180 -95.71 153.65 17.62 Favored 'General case' 0 N--CA 1.449 -0.493 0 N-CA-C 109.109 -0.7 . . . . 0.0 109.109 179.188 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 22' ' ' PHE . . . . . . . . . . . . . 92.9 m-85 -134.88 144.27 47.44 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 106.728 -1.582 . . . . 0.0 106.728 -179.814 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -74.78 171.16 12.28 Favored Pre-proline 0 CA--C 1.544 0.741 0 N-CA-C 108.075 -1.083 . . . . 0.0 108.075 179.948 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 24' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -66.94 -31.32 38.12 Favored 'Trans proline' 0 N--CA 1.459 -0.547 0 C-N-CA 121.472 1.448 . . . . 0.0 113.562 -178.332 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 25' ' ' VAL . . . . . . . . . . . . . 89.8 t -75.37 -40.8 42.81 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.307 0 N-CA-C 109.031 -0.729 . . . . 0.0 109.031 -179.832 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -62.86 -48.18 80.13 Favored 'General case' 0 C--O 1.217 -0.631 0 N-CA-C 108.164 -1.051 . . . . 0.0 108.164 179.889 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 27' ' ' ASP . . . . . . . . . . . . . 20.9 t0 -56.03 -48.51 75.84 Favored 'General case' 0 CA--C 1.515 -0.385 0 C-N-CA 124.899 1.28 . . . . 0.0 111.169 -179.514 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 28' ' ' GLU . . . . . . . . . . . . . 36.1 tt0 -60.51 -47.15 87.42 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 124.58 1.152 . . . . 0.0 108.833 179.097 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 31.7 m -60.89 -55.15 36.37 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 124.167 0.987 . . . . 0.0 110.428 179.484 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 96.7 mt -62.21 -30.83 49.73 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.48 0 C-N-CA 126.132 1.773 . . . . 0.0 110.641 -178.654 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 9.6 ttt85 -67.58 -43.82 79.64 Favored 'General case' 0 C--N 1.327 -0.395 0 O-C-N 120.515 -1.366 . . . . 0.0 110.104 179.437 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 1.2 mptm? -78.47 -44.46 24.53 Favored 'General case' 0 C--O 1.225 -0.214 0 CA-C-O 117.552 -1.213 . . . . 0.0 113.918 -178.07 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 34.9 tptt -62.64 -39.68 94.61 Favored 'General case' 0 N--CA 1.462 0.166 0 CA-C-N 119.966 1.257 . . . . 0.0 110.615 -178.109 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 34' ' ' ALA . . . . . . . . . . . . . . . -58.73 -55.74 31.17 Favored 'General case' 0 N--CA 1.448 -0.539 0 C-N-CA 124.839 1.256 . . . . 0.0 109.019 179.072 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 16.8 tt0 -65.46 -34.89 79.35 Favored 'General case' 0 N--CA 1.453 -0.316 0 CA-C-N 115.37 -0.832 . . . . 0.0 113.027 -178.321 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 36' ' ' ASP . . . . . . . . . . . . . 18.3 t70 -64.86 -40.85 95.79 Favored 'General case' 0 C--O 1.235 0.334 0 N-CA-C 107.929 -1.137 . . . . 0.0 107.929 178.361 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 37' ' ' SER . . . . . . . . . . . . . 6.9 t -77.75 -7.17 56.17 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 124.887 1.275 . . . . 0.0 110.671 178.821 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 72.7 2.54 56.7 Favored Glycine 0 CA--C 1.534 1.265 0 C-N-CA 125.032 1.301 . . . . 0.0 112.257 -179.068 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 39' ' ' LEU . . . . . . . . . . . . . 11.2 mt -99.6 106.31 18.27 Favored 'General case' 0 N--CA 1.447 -0.6 0 C-N-CA 125.952 1.701 . . . . 0.0 107.294 -179.52 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 40' ' ' THR . . . . . . . . . . . . . 8.8 t -45.27 150.83 0.4 Allowed 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 124.947 1.299 . . . . 0.0 109.67 179.016 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 41' ' ' VAL . . . . . . . . . . . . . 65.4 t -43.46 -44.64 1.61 Allowed 'Isoleucine or valine' 0 N--CA 1.461 0.096 0 C-N-CA 125.85 1.66 . . . . 0.0 112.473 -177.705 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 42' ' ' SER . . . . . . . . . . . . . 1.4 p -61.41 -46.75 88.84 Favored 'General case' 0 CA--C 1.538 0.489 0 CA-C-N 119.518 1.053 . . . . 0.0 111.615 179.896 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -66.52 -39.03 88.41 Favored 'General case' 0 C--O 1.225 -0.2 0 C-N-CA 123.251 0.621 . . . . 0.0 109.566 178.557 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 44' ' ' TYR . . . . . . . . . . . . . 61.7 t80 -58.82 -52.85 63.96 Favored 'General case' 0 C--O 1.221 -0.413 0 N-CA-C 108.495 -0.928 . . . . 0.0 108.495 179.134 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 45' ' ' ILE . . . . . . . . . . . . . 21.2 mm -53.45 -61.63 0.84 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.196 0 C-N-CA 124.173 0.989 . . . . 0.0 109.577 179.819 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 46' ' ' ARG . . . . . . . . . . . . . 18.4 ptt180 -52.0 -47.51 64.88 Favored 'General case' 0 CA--C 1.53 0.194 0 N-CA-C 112.704 0.631 . . . . 0.0 112.704 -179.012 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 47' ' ' ASN . . . . . . . . . . . . . 32.6 t30 -66.05 -52.44 48.96 Favored 'General case' 0 C--N 1.329 -0.322 0 C-N-CA 125.37 1.468 . . . . 0.0 112.987 -179.352 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -61.84 -33.26 73.84 Favored 'General case' 0 C--O 1.223 -0.333 0 C-N-CA 125.293 1.437 . . . . 0.0 110.976 -179.594 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 49' ' ' ALA . . . . . . . . . . . . . . . -66.71 -55.57 14.51 Favored 'General case' 0 N--CA 1.444 -0.762 0 C-N-CA 122.41 0.284 . . . . 0.0 111.02 -179.77 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 14.8 mt -69.62 -40.19 76.74 Favored 'General case' 0 CA--C 1.516 -0.341 0 N-CA-C 115.562 1.69 . . . . 0.0 115.562 -177.327 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 51' ' ' ASN . . . . . . . . . . . . . 57.0 m-80 . . . . . 0 C--O 1.251 1.153 0 CA-C-O 118.321 -0.847 . . . . 0.0 111.165 -176.774 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 11.8 t . . . . . 0 N--CA 1.437 -1.1 0 N-CA-C 107.844 -1.169 . . . . 0.0 107.844 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 95.9 t -97.28 154.64 3.69 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.879 0 N-CA-C 104.457 -2.423 . . . . 0.0 104.457 177.835 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 8.3 p -144.09 101.85 0.7 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.532 0 N-CA-C 105.598 -2.001 . . . . 0.0 105.598 178.68 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 10.6 ttm180 -144.09 172.7 12.53 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 107.843 -1.169 . . . . 0.0 107.843 179.392 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -121.59 136.87 54.93 Favored 'General case' 0 C--N 1.321 -0.637 0 C-N-CA 127.217 2.207 . . . . 0.0 107.597 -179.567 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 74.0 mt -120.84 170.8 9.13 Favored 'General case' 0 C--O 1.236 0.39 0 N-CA-C 107.464 -1.309 . . . . 0.0 107.464 178.547 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 23.4 mmt-85 -128.77 151.16 49.88 Favored 'General case' 0 C--N 1.327 -0.412 0 C-N-CA 124.978 1.311 . . . . 0.0 107.967 179.639 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 98.5 m-85 -147.87 140.91 24.95 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 106.429 -1.693 . . . . 0.0 106.429 179.588 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 1.5 m -68.96 172.14 5.37 Favored Pre-proline 0 CA--C 1.545 0.755 0 C-N-CA 124.26 1.024 . . . . 0.0 108.664 179.381 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 59.4 Cg_endo -67.72 -38.28 14.21 Favored 'Trans proline' 0 N--CA 1.458 -0.609 0 CA-C-N 121.271 1.49 . . . . 0.0 111.351 -179.067 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 21.3 t -72.46 -36.38 54.34 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.488 0 C-N-CA 123.105 0.562 . . . . 0.0 109.796 179.632 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -67.85 -42.66 81.03 Favored 'General case' 0 C--O 1.225 -0.224 0 N-CA-C 108.724 -0.843 . . . . 0.0 108.724 179.377 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 26.5 t70 -65.4 -46.02 81.68 Favored 'General case' 0 C--O 1.224 -0.286 0 N-CA-C 108.915 -0.772 . . . . 0.0 108.915 178.763 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 63.9 tt0 -54.74 -48.57 72.4 Favored 'General case' 0 N--CA 1.452 -0.367 0 C-N-CA 125.112 1.365 . . . . 0.0 108.052 178.23 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 46.1 m -67.51 -51.31 52.6 Favored 'General case' 0 C--O 1.222 -0.388 0 C-N-CA 124.149 0.98 . . . . 0.0 111.3 -179.441 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 59.6 mt -60.25 -31.96 49.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 O-C-N 120.52 -1.363 . . . . 0.0 110.109 -179.436 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 31.9 ttt180 -76.24 -45.14 34.31 Favored 'General case' 0 CA--C 1.511 -0.545 0 N-CA-C 109.318 -0.623 . . . . 0.0 109.318 -179.151 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . 0.391 0.0 OUTLIER -66.04 -30.64 71.21 Favored 'General case' 0 N--CA 1.45 -0.447 0 O-C-N 123.277 0.361 . . . . 0.0 110.259 -179.856 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 7.4 mmmm -77.48 -48.91 15.92 Favored 'General case' 0 C--O 1.222 -0.362 0 N-CA-C 107.346 -1.353 . . . . 0.0 107.346 178.178 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -54.4 -57.14 12.45 Favored 'General case' 0 C--N 1.339 0.112 0 C-N-CA 124.083 0.953 . . . . 0.0 110.278 -179.803 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 7.5 tp10 -62.96 -41.26 99.47 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-O 118.881 -0.581 . . . . 0.0 111.845 -179.059 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 37.0 t70 -66.36 -26.84 67.46 Favored 'General case' 0 N--CA 1.47 0.571 0 CA-C-N 119.435 1.016 . . . . 0.0 110.724 179.771 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 1.7 t -89.81 -2.28 58.18 Favored 'General case' 0 N--CA 1.447 -0.625 0 C-N-CA 124.533 1.133 . . . . 0.0 110.119 178.861 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 65.23 33.97 88.29 Favored Glycine 0 CA--C 1.526 0.77 0 CA-C-O 118.835 -0.98 . . . . 0.0 112.569 179.627 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 81.0 mt -128.29 152.58 47.96 Favored 'General case' 0 C--O 1.233 0.23 0 C-N-CA 125.502 1.521 . . . . 0.0 108.589 179.924 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -76.71 148.48 36.75 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 104.24 -2.504 . . . . 0.0 104.24 177.183 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 20.1 t -50.35 -39.78 17.35 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.539 0 C-N-CA 124.683 1.193 . . . . 0.0 109.477 177.844 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 66.2 p -58.75 -48.14 82.24 Favored 'General case' 0 CA--C 1.539 0.555 0 O-C-N 121.105 -0.997 . . . . 0.0 111.777 179.47 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -67.6 -46.44 72.58 Favored 'General case' 0 C--O 1.221 -0.403 0 C-N-CA 125.09 1.356 . . . . 0.0 108.581 179.053 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 55.0 t80 -52.66 -53.66 44.09 Favored 'General case' 0 N--CA 1.451 -0.379 0 C-N-CA 124.703 1.201 . . . . 0.0 109.487 179.959 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 18.4 mm -51.94 -62.11 0.63 Allowed 'Isoleucine or valine' 0 C--N 1.341 0.218 0 C-N-CA 124.575 1.15 . . . . 0.0 111.258 -179.784 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 12.7 ptm180 -60.92 -46.28 91.31 Favored 'General case' 0 C--O 1.222 -0.374 0 CA-C-O 118.687 -0.673 . . . . 0.0 111.687 -178.682 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 10.7 t30 -51.96 -55.22 21.7 Favored 'General case' 0 C--N 1.332 -0.184 0 C-N-CA 124.405 1.082 . . . . 0.0 110.089 -179.443 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -66.18 -29.83 70.18 Favored 'General case' 0 N--CA 1.453 -0.298 0 C-N-CA 124.99 1.316 . . . . 0.0 113.149 179.924 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -81.38 -19.8 41.9 Favored 'General case' 0 N--CA 1.462 0.151 0 N-CA-C 113.362 0.875 . . . . 0.0 113.362 -179.303 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 23.4 mt -106.19 -36.98 6.73 Favored 'General case' 0 CA--C 1.516 -0.332 0 N-CA-C 114.015 1.117 . . . . 0.0 114.015 -178.533 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 12.7 m-80 . . . . . 0 C--O 1.248 1.015 0 CA-C-O 117.805 -1.093 . . . . 0.0 110.972 -176.975 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 14.3 t . . . . . 0 N--CA 1.44 -0.955 0 N-CA-C 106.634 -1.617 . . . . 0.0 106.634 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 5.4 t -109.8 156.97 10.47 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.574 0 N-CA-C 106.515 -1.661 . . . . 0.0 106.515 177.909 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 11.5 p -137.69 113.67 11.06 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.681 0 N-CA-C 105.182 -2.155 . . . . 0.0 105.182 176.939 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 34.5 ttm-85 -145.19 149.11 34.37 Favored 'General case' 0 CA--C 1.514 -0.422 0 CA-C-O 121.059 0.457 . . . . 0.0 109.8 178.936 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -93.85 132.77 37.93 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 107.402 -1.333 . . . . 0.0 107.402 -179.482 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 69.9 mt -129.49 151.96 49.54 Favored 'General case' 0 C--O 1.239 0.542 0 N-CA-C 107.532 -1.284 . . . . 0.0 107.532 178.747 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 22.0 mmt85 -112.6 151.19 30.37 Favored 'General case' 0 C--N 1.323 -0.571 0 C-N-CA 127.977 2.511 . . . . 0.0 108.234 -179.798 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 22' ' ' PHE . . . . . . . . . . . . . 89.7 m-85 -148.73 139.43 22.78 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 104.829 -2.285 . . . . 0.0 104.829 178.769 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 4.7 m -70.57 168.54 18.97 Favored Pre-proline 0 CA--C 1.551 1.012 0 N-CA-C 108.279 -1.008 . . . . 0.0 108.279 179.408 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 24' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -66.14 -40.88 14.33 Favored 'Trans proline' 0 N--CA 1.46 -0.456 0 C-N-CA 122.475 2.117 . . . . 0.0 114.178 -177.363 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 25' ' ' VAL . . . . . . . . . . . . . 77.1 t -66.81 -45.62 87.31 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.305 0 C-N-CA 123.94 0.896 . . . . 0.0 109.51 -179.709 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -68.08 -38.85 82.84 Favored 'General case' 0 N--CA 1.453 -0.297 0 C-N-CA 124.68 1.192 . . . . 0.0 110.983 -178.495 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 27' ' ' ASP . . . . . . . . . . . . . 10.1 t70 -64.59 -44.1 91.7 Favored 'General case' 0 N--CA 1.454 -0.264 0 C-N-CA 123.102 0.561 . . . . 0.0 109.998 178.473 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 28' ' ' GLU . . . . . . . . . . . . . 26.5 tt0 -62.16 -45.75 92.02 Favored 'General case' 0 N--CA 1.449 -0.514 0 N-CA-C 108.105 -1.072 . . . . 0.0 108.105 179.556 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 31.0 m -56.06 -52.91 62.56 Favored 'General case' 0 C--N 1.341 0.199 0 N-CA-C 108.512 -0.921 . . . . 0.0 108.512 178.699 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 84.4 mt -58.0 -41.17 79.66 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.3 0 C-N-CA 122.66 0.384 . . . . 0.0 110.099 -179.717 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 37.4 ttt-85 -61.42 -47.43 85.81 Favored 'General case' 0 C--O 1.23 0.067 0 O-C-N 121.45 -0.781 . . . . 0.0 110.62 -179.647 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 2.6 mptm? -65.48 -46.83 78.2 Favored 'General case' 0 CA--C 1.523 -0.083 0 C-N-CA 123.008 0.523 . . . . 0.0 110.473 -179.593 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 9.1 mmmm -59.46 -48.31 82.13 Favored 'General case' 0 CA--C 1.527 0.065 0 N-CA-C 109.272 -0.64 . . . . 0.0 109.272 -179.655 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 34' ' ' ALA . . . . . . . . . . . . . . . -59.43 -49.77 76.52 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 124.768 1.227 . . . . 0.0 112.156 -179.821 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 5.4 tp10 -56.0 -49.69 72.94 Favored 'General case' 0 C--O 1.233 0.186 0 C-N-CA 124.414 1.086 . . . . 0.0 110.696 -179.495 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 36' ' ' ASP . . . . . . . . . . . . . 6.8 t70 -67.89 -44.05 77.88 Favored 'General case' 0 N--CA 1.454 -0.262 0 C-N-CA 124.107 0.963 . . . . 0.0 111.875 -178.927 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 37' ' ' SER . . . . . . . . . . . . . 30.4 t -66.24 -18.77 65.56 Favored 'General case' 0 N--CA 1.448 -0.556 0 C-N-CA 124.403 1.081 . . . . 0.0 110.943 -179.453 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 73.47 20.35 79.84 Favored Glycine 0 CA--C 1.528 0.893 0 N-CA-C 110.632 -0.987 . . . . 0.0 110.632 -179.189 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 39' ' ' LEU . . . . . . . . . . . . . 81.4 mt -120.45 107.81 13.34 Favored 'General case' 0 N--CA 1.447 -0.576 0 N-CA-C 103.121 -2.918 . . . . 0.0 103.121 179.56 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 40' ' ' THR . . . . . . . . . . . . . 13.8 t -50.76 156.3 0.98 Allowed 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 123.342 0.657 . . . . 0.0 109.502 -179.776 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 41' ' ' VAL . . . . . . . . . . . . . 80.8 t -44.99 -43.97 2.72 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.418 0 C-N-CA 125.019 1.328 . . . . 0.0 112.804 -177.74 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 42' ' ' SER . . . . . . . . . . . . . 9.8 p -65.48 -42.77 91.85 Favored 'General case' 0 CA--C 1.542 0.642 0 CA-C-N 119.256 0.935 . . . . 0.0 112.276 179.474 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -66.31 -45.39 80.53 Favored 'General case' 0 C--O 1.226 -0.183 0 C-N-CA 125.545 1.538 . . . . 0.0 108.921 178.941 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 44' ' ' TYR . . . . . . . . . . . . . 72.3 t80 -56.25 -51.31 68.6 Favored 'General case' 0 N--CA 1.443 -0.781 0 C-N-CA 125.685 1.594 . . . . 0.0 109.256 179.627 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 45' ' ' ILE . . . . . . . . . . . . . 9.0 mm -56.12 -58.94 3.41 Favored 'Isoleucine or valine' 0 C--N 1.34 0.162 0 C-N-CA 123.427 0.691 . . . . 0.0 110.952 179.561 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 46' ' ' ARG . . . . . . . . . . . . . 13.3 ptm180 -57.52 -48.97 77.84 Favored 'General case' 0 C--O 1.221 -0.426 0 CA-C-O 118.213 -0.898 . . . . 0.0 111.113 -178.832 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 47' ' ' ASN . . . . . . . . . . . . . 20.1 t30 -55.4 -55.94 25.89 Favored 'General case' 0 N--CA 1.452 -0.349 0 CA-C-N 118.935 0.789 . . . . 0.0 110.837 -179.493 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -59.9 -26.8 66.2 Favored 'General case' 0 CA--C 1.531 0.245 0 C-N-CA 123.529 0.732 . . . . 0.0 112.816 -179.486 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 49' ' ' ALA . . . . . . . . . . . . . . . -84.29 -12.48 54.59 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 124.176 0.991 . . . . 0.0 113.073 179.746 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 14.2 mt -109.99 -30.06 7.96 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 118.856 0.753 . . . . 0.0 111.481 179.749 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 51' ' ' ASN . . . . . . . . . . . . . 11.8 m-80 . . . . . 0 C--O 1.249 1.048 0 C-N-CA 126.057 1.743 . . . . 0.0 109.805 -178.815 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 3.4 p . . . . . 0 N--CA 1.469 0.488 0 CA-C-O 120.729 0.3 . . . . 0.0 111.204 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -156.47 177.45 11.45 Favored 'General case' 0 C--O 1.234 0.267 0 C-N-CA 125.084 1.354 . . . . 0.0 107.968 178.849 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 5.7 m -150.51 168.87 22.94 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 106.999 -1.482 . . . . 0.0 106.999 178.47 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -55.62 -71.34 0.09 Allowed 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 123.355 0.662 . . . . 0.0 110.62 -179.916 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 27.6 m -76.28 7.26 0.71 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.694 0 C-N-CA 124.783 1.233 . . . . 0.0 113.582 -179.656 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 49.8 mtt180 -141.52 80.0 1.71 Allowed 'General case' 0 N--CA 1.465 0.303 0 O-C-N 120.211 -1.556 . . . . 0.0 108.553 179.772 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 1.5 ttmp? -130.35 24.32 5.17 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 124.542 1.137 . . . . 0.0 110.531 -179.785 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.59 8.6 0.81 Allowed 'General case' 0 CA--C 1.539 0.549 0 O-C-N 120.772 -1.205 . . . . 0.0 113.029 179.375 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -62.71 -56.45 17.54 Favored 'General case' 0 N--CA 1.449 -0.486 0 C-N-CA 126.043 1.737 . . . . 0.0 110.495 179.454 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 20.3 tt0 -158.84 164.2 35.95 Favored 'General case' 0 C--O 1.237 0.399 0 C-N-CA 124.825 1.25 . . . . 0.0 109.223 -179.439 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 20.1 t -133.84 -89.43 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.451 -0.414 0 C-N-CA 126.02 1.728 . . . . 0.0 106.509 178.902 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 8.0 ptm180 -157.7 161.3 38.54 Favored 'General case' 0 C--O 1.238 0.45 0 C-N-CA 127.942 2.497 . . . . 0.0 107.343 -179.531 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 28.3 mm-40 -78.82 91.81 4.78 Favored 'General case' 0 C--N 1.332 -0.182 0 N-CA-C 106.302 -1.74 . . . . 0.0 106.302 178.772 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 18.7 ptmt -57.49 -47.36 82.1 Favored 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 123.959 0.904 . . . . 0.0 108.886 179.211 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 8.4 t -79.34 155.8 28.28 Favored 'General case' 0 N--CA 1.434 -1.254 0 N-CA-C 108.59 -0.893 . . . . 0.0 108.59 179.467 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 2.5 t -103.92 134.34 45.44 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.801 0 N-CA-C 104.763 -2.31 . . . . 0.0 104.763 178.344 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 8.8 p -127.32 111.63 25.87 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 N-CA-C 106.295 -1.743 . . . . 0.0 106.295 179.102 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 61.6 ttm-85 -141.68 157.7 44.74 Favored 'General case' 0 CA--C 1.52 -0.206 0 CA-C-N 115.447 -0.797 . . . . 0.0 108.972 -179.807 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 45.0 m -95.7 110.03 22.23 Favored 'General case' 0 N--CA 1.448 -0.544 0 N-CA-C 104.62 -2.363 . . . . 0.0 104.62 178.674 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 12.6 tp -104.24 145.9 29.56 Favored 'General case' 0 C--O 1.237 0.428 0 N-CA-C 106.839 -1.541 . . . . 0.0 106.839 179.841 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 33.1 mtt180 -127.74 161.3 29.28 Favored 'General case' 0 N--CA 1.453 -0.298 0 C-N-CA 123.529 0.732 . . . . 0.0 110.306 -179.538 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 95.1 m-85 -149.49 159.03 44.65 Favored 'General case' 0 N--CA 1.465 0.298 0 C-N-CA 124.311 1.045 . . . . 0.0 108.818 -179.117 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -84.91 169.87 15.15 Favored Pre-proline 0 CA--C 1.542 0.658 0 N-CA-C 108.477 -0.935 . . . . 0.0 108.477 178.578 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -61.49 -32.64 88.5 Favored 'Trans proline' 0 C--N 1.349 0.602 0 C-N-CA 122.04 1.827 . . . . 0.0 111.811 -178.834 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 93.4 t -66.23 -58.38 6.86 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.419 0 C-N-CA 125.885 1.674 . . . . 0.0 108.511 179.526 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -56.66 -40.15 74.99 Favored 'General case' 0 CA--C 1.521 -0.148 0 CA-C-N 118.146 0.43 . . . . 0.0 111.389 -179.722 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 32.8 t70 -65.49 -42.68 91.89 Favored 'General case' 0 CA--C 1.512 -0.483 0 C-N-CA 123.989 0.916 . . . . 0.0 110.994 179.647 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 34.9 tt0 -60.28 -52.64 64.43 Favored 'General case' 0 N--CA 1.448 -0.56 0 N-CA-C 107.738 -1.208 . . . . 0.0 107.738 179.328 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 57.0 m -56.41 -56.46 20.92 Favored 'General case' 0 N--CA 1.451 -0.385 0 C-N-CA 123.046 0.538 . . . . 0.0 110.161 -179.194 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 27.8 mt -58.82 -43.38 88.02 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.536 0 N-CA-C 112.412 0.523 . . . . 0.0 112.412 -178.576 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 31.6 ttt180 -59.14 -47.0 86.9 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 118.616 0.644 . . . . 0.0 109.814 179.63 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 2.3 mptm? -66.72 -40.89 88.57 Favored 'General case' 0 CA--C 1.529 0.153 0 CA-C-O 119.456 -0.307 . . . . 0.0 110.248 -179.726 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 8.4 tptt -64.73 -44.41 90.26 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-N 118.994 0.815 . . . . 0.0 111.118 -179.361 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -61.55 -53.16 59.96 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 124.377 1.071 . . . . 0.0 111.12 -179.856 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 3.7 tp10 -65.18 -36.18 83.39 Favored 'General case' 0 C--O 1.233 0.227 0 N-CA-C 113.419 0.896 . . . . 0.0 113.419 -177.137 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 30.3 t70 -67.83 -40.88 83.73 Favored 'General case' 0 CA--C 1.517 -0.322 0 N-CA-C 109.894 -0.41 . . . . 0.0 109.894 179.112 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 9.4 t -75.7 -14.05 60.33 Favored 'General case' 0 N--CA 1.452 -0.326 0 CA-C-N 115.784 -0.643 . . . . 0.0 111.68 -179.337 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 71.92 39.89 58.39 Favored Glycine 0 CA--C 1.526 0.733 0 N-CA-C 108.955 -1.658 . . . . 0.0 108.955 -178.876 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 84.2 mt -128.32 137.1 51.79 Favored 'General case' 0 N--CA 1.448 -0.552 0 N-CA-C 103.109 -2.922 . . . . 0.0 103.109 179.021 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 5.7 t -70.6 155.67 40.44 Favored 'General case' 0 C--N 1.319 -0.728 0 N-CA-C 106.053 -1.832 . . . . 0.0 106.053 178.226 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 74.3 t -52.73 -40.93 36.79 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.452 0 O-C-N 121.033 -1.042 . . . . 0.0 111.988 -179.601 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 65.3 p -61.97 -46.85 87.44 Favored 'General case' 0 N--CA 1.468 0.431 0 CA-C-N 119.494 1.043 . . . . 0.0 110.921 -179.855 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.88 -45.04 91.16 Favored 'General case' 0 C--O 1.219 -0.51 0 N-CA-C 108.238 -1.023 . . . . 0.0 108.238 178.311 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 92.5 t80 -54.35 -48.85 70.96 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 123.806 0.842 . . . . 0.0 109.928 -179.835 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 5.1 mm -56.45 -65.32 0.4 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.241 0 C-N-CA 125.051 1.34 . . . . 0.0 110.88 179.667 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 10.6 ptt180 -57.53 -39.96 77.74 Favored 'General case' 0 C--O 1.22 -0.463 0 CA-C-O 118.898 -0.572 . . . . 0.0 110.442 -178.833 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 8.9 t30 -58.31 -56.98 15.09 Favored 'General case' 0 N--CA 1.453 -0.277 0 C-N-CA 124.07 0.948 . . . . 0.0 109.298 179.432 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -60.11 -34.2 73.17 Favored 'General case' 0 CA--C 1.532 0.264 0 CA-C-O 121.362 0.601 . . . . 0.0 111.132 -179.797 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -67.74 -26.84 66.34 Favored 'General case' 0 CA--C 1.538 0.508 0 O-C-N 121.283 -0.886 . . . . 0.0 113.187 -179.885 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 6.1 mt -100.4 -31.59 11.24 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-N 119.32 0.964 . . . . 0.0 112.069 -178.652 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 38.4 m-80 . . . . . 0 C--O 1.247 0.958 0 C-N-CA 124.712 1.205 . . . . 0.0 108.134 179.583 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 1' ' ' SER . . . . . . . . . . . . . 2.9 p . . . . . 0 N--CA 1.472 0.657 0 N-CA-C 109.651 -0.5 . . . . 0.0 109.651 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 2' ' ' ASP . . . . . . . . . . . . . 2.6 p-10 -164.15 -172.91 2.94 Favored 'General case' 0 N--CA 1.464 0.254 0 O-C-N 121.144 -0.972 . . . . 0.0 109.671 -179.532 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 3' ' ' SER . . . . . . . . . . . . . 58.6 m -158.09 154.66 27.89 Favored 'General case' 0 N--CA 1.448 -0.574 0 C-N-CA 127.62 2.368 . . . . 0.0 104.974 177.472 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 4' ' ' ALA . . . . . . . . . . . . . . . -53.31 -37.83 62.6 Favored 'General case' 0 CA--C 1.537 0.454 0 N-CA-C 112.727 0.64 . . . . 0.0 112.727 -179.525 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 9.8 p -103.98 3.51 10.58 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.721 0 C-N-CA 124.382 1.073 . . . . 0.0 112.489 -179.517 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 6' ' ' ARG . . . . . . . . . . . . . 33.9 mtt180 -131.88 68.94 1.48 Allowed 'General case' 0 N--CA 1.467 0.403 0 O-C-N 119.977 -1.702 . . . . 0.0 108.673 179.998 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 4.1 ttmp? -136.53 78.58 1.71 Allowed 'General case' 0 N--CA 1.45 -0.463 0 N-CA-C 105.734 -1.95 . . . . 0.0 105.734 178.907 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 6.3 mptt -125.04 6.25 7.93 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 125.705 1.602 . . . . 0.0 109.43 179.122 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 1.8 p -60.55 -64.86 0.8 Allowed 'General case' 0 N--CA 1.449 -0.479 0 C-N-CA 125.382 1.473 . . . . 0.0 109.951 -179.328 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 10' ' ' GLU . . . . . . . . . . . . . 7.9 tt0 -155.79 83.64 1.02 Allowed 'General case' 0 CA--C 1.534 0.349 0 N-CA-C 108.772 -0.825 . . . . 0.0 108.772 179.975 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 11' ' ' VAL . . . . . . . . . . . . . 60.1 t -62.19 -62.77 1.0 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.362 0 C-N-CA 123.337 0.655 . . . . 0.0 109.616 179.759 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 12' ' ' ARG . . . . . . . . . . . . . 26.6 ttm180 -170.26 147.32 3.08 Favored 'General case' 0 C--O 1.239 0.518 0 C-N-CA 126.279 1.831 . . . . 0.0 107.398 179.889 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 13' ' ' GLN . . . . . . . . . . . . . 58.0 mm-40 -78.34 94.25 4.81 Favored 'General case' 0 CA--C 1.516 -0.359 0 N-CA-C 103.791 -2.67 . . . . 0.0 103.791 177.727 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 40.7 pttt -68.83 -34.86 76.2 Favored 'General case' 0 N--CA 1.449 -0.514 0 N-CA-C 108.253 -1.017 . . . . 0.0 108.253 178.925 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 6.0 t -74.65 154.38 38.52 Favored 'General case' 0 N--CA 1.437 -1.09 0 N-CA-C 107.066 -1.457 . . . . 0.0 107.066 178.09 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 2.4 t -101.07 154.39 4.68 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.911 0 N-CA-C 103.77 -2.678 . . . . 0.0 103.77 177.278 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 11.2 p -145.81 115.39 1.56 Allowed 'Isoleucine or valine' 0 N--CA 1.444 -0.73 0 N-CA-C 106.524 -1.658 . . . . 0.0 106.524 179.468 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 49.0 ttm-85 -152.96 161.19 42.84 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.615 0.721 . . . . 0.0 110.721 -179.63 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -96.92 110.88 23.3 Favored 'General case' 0 N--CA 1.446 -0.646 0 N-CA-C 105.484 -2.043 . . . . 0.0 105.484 179.219 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -109.17 108.89 19.7 Favored 'General case' 0 C--O 1.236 0.357 0 N-CA-C 106.537 -1.653 . . . . 0.0 106.537 -179.887 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 5.7 mtp180 -87.37 153.28 21.57 Favored 'General case' 0 C--N 1.334 -0.065 0 C-N-CA 122.73 0.412 . . . . 0.0 110.254 -179.916 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 22' ' ' PHE . . . . . . . . . . . . . 87.7 m-85 -141.2 143.77 34.39 Favored 'General case' 0 N--CA 1.468 0.471 0 N-CA-C 107.97 -1.122 . . . . 0.0 107.97 179.921 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 1.2 m -74.1 167.03 39.41 Favored Pre-proline 0 CA--C 1.538 0.499 0 CA-C-O 118.254 -0.879 . . . . 0.0 108.986 179.882 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 24' ' ' PRO . . . . . . . . . . . . . 61.0 Cg_endo -67.97 -33.2 26.71 Favored 'Trans proline' 0 C--N 1.346 0.427 0 C-N-CA 121.91 1.74 . . . . 0.0 112.283 -179.181 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 25' ' ' VAL . . . . . . . . . . . . . 61.9 t -64.8 -52.02 59.61 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.413 0 N-CA-C 107.847 -1.168 . . . . 0.0 107.847 179.637 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 1.4 mp0 -63.32 -44.55 94.62 Favored 'General case' 0 C--O 1.222 -0.368 0 C-N-CA 124.156 0.982 . . . . 0.0 110.477 179.276 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 27' ' ' ASP . . . . . . . . . . . . . 6.7 t70 -57.13 -45.22 83.67 Favored 'General case' 0 C--O 1.223 -0.298 0 C-N-CA 125.714 1.606 . . . . 0.0 111.446 -179.685 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 28' ' ' GLU . . . . . . . . . . . . . 46.3 tt0 -63.42 -46.52 85.98 Favored 'General case' 0 N--CA 1.448 -0.549 0 N-CA-C 108.614 -0.884 . . . . 0.0 108.614 178.866 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 52.0 m -62.27 -47.87 82.43 Favored 'General case' 0 C--N 1.333 -0.11 0 O-C-N 121.695 -0.628 . . . . 0.0 110.524 179.226 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 79.2 mt -63.37 -38.4 82.07 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.634 0 CA-C-O 122.415 1.102 . . . . 0.0 108.399 179.759 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 70.0 ttt180 -64.66 -38.3 90.52 Favored 'General case' 0 C--N 1.327 -0.378 0 O-C-N 118.881 -2.387 . . . . 0.0 109.29 178.226 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -71.8 -48.22 47.94 Favored 'General case' 0 C--N 1.33 -0.262 0 C-N-CA 123.937 0.895 . . . . 0.0 112.462 -179.151 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 12.7 mptt -66.45 -46.11 77.53 Favored 'General case' 0 C--O 1.225 -0.221 0 CA-C-O 118.026 -0.988 . . . . 0.0 108.604 -179.857 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 34' ' ' ALA . . . . . . . . . . . . . . . -53.7 -56.31 18.45 Favored 'General case' 0 CA--C 1.528 0.123 0 CA-C-N 119.317 0.962 . . . . 0.0 110.183 179.284 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 5.2 tp10 -63.17 -39.28 94.19 Favored 'General case' 0 C--O 1.232 0.153 0 N-CA-C 112.578 0.585 . . . . 0.0 112.578 -178.303 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 36' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -69.3 -35.57 76.12 Favored 'General case' 0 N--CA 1.46 0.055 0 CA-C-N 118.453 0.57 . . . . 0.0 110.355 179.622 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 37' ' ' SER . . . . . . . . . . . . . 13.9 t -75.92 -12.14 60.09 Favored 'General case' 0 CA--C 1.541 0.628 0 N-CA-C 108.911 -0.774 . . . . 0.0 108.911 178.234 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 75.44 29.6 59.68 Favored Glycine 0 C--N 1.339 0.696 0 O-C-N 121.126 -0.984 . . . . 0.0 110.74 -179.504 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 39' ' ' LEU . . . . . . . . . . . . . 87.6 mt -120.9 159.05 26.32 Favored 'General case' 0 N--CA 1.445 -0.71 0 C-N-CA 125.469 1.508 . . . . 0.0 107.929 179.425 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 40' ' ' THR . . . . . 0.495 HG23 ' H ' ' B' ' 43' ' ' ALA . 1.6 t -81.39 151.9 27.71 Favored 'General case' 0 C--N 1.322 -0.609 0 N-CA-C 104.109 -2.552 . . . . 0.0 104.109 176.799 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 41' ' ' VAL . . . . . . . . . . . . . 42.2 t -48.17 -42.09 10.73 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.659 0 C-N-CA 125.217 1.407 . . . . 0.0 109.627 178.516 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 42' ' ' SER . . . . . . . . . . . . . 13.2 p -60.37 -51.08 71.04 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-N 119.648 1.113 . . . . 0.0 111.39 179.465 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 43' ' ' ALA . . . . . 0.495 ' H ' HG23 ' B' ' 40' ' ' THR . . . -61.04 -42.85 99.25 Favored 'General case' 0 C--O 1.223 -0.302 0 C-N-CA 123.601 0.761 . . . . 0.0 109.023 179.193 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 44' ' ' TYR . . . . . . . . . . . . . 46.8 t80 -58.39 -50.63 72.98 Favored 'General case' 0 N--CA 1.445 -0.709 0 N-CA-C 109.444 -0.576 . . . . 0.0 109.444 179.486 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 45' ' ' ILE . . . . . . . . . . . . . 22.7 mm -55.44 -61.03 1.21 Allowed 'Isoleucine or valine' 0 C--N 1.34 0.189 0 C-N-CA 124.036 0.934 . . . . 0.0 110.214 179.762 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 46' ' ' ARG . . . . . . . . . . . . . 26.9 ptt180 -53.92 -49.11 69.37 Favored 'General case' 0 C--O 1.223 -0.33 0 CA-C-O 118.967 -0.54 . . . . 0.0 111.384 -178.566 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 47' ' ' ASN . . . . . . . . . . . . . 24.0 t30 -60.34 -51.76 68.14 Favored 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 124.195 0.998 . . . . 0.0 112.692 -179.075 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -61.45 -35.57 77.97 Favored 'General case' 0 C--O 1.222 -0.344 0 O-C-N 123.82 0.7 . . . . 0.0 111.528 -179.858 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 49' ' ' ALA . . . . . . . . . . . . . . . -77.07 -24.25 51.92 Favored 'General case' 0 N--CA 1.447 -0.595 0 N-CA-C 113.575 0.954 . . . . 0.0 113.575 -178.79 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 24.8 mt -84.96 -40.75 16.58 Favored 'General case' 0 CA--C 1.513 -0.47 0 CA-C-N 118.734 0.697 . . . . 0.0 111.172 -179.671 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 51' ' ' ASN . . . . . . . . . . . . . 69.5 m-80 . . . . . 0 C--O 1.247 0.924 0 CA-C-O 116.301 -1.809 . . . . 0.0 108.952 179.808 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 1.4 m . . . . . 0 N--CA 1.467 0.395 0 N-CA-C 108.361 -0.977 . . . . 0.0 108.361 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 39.5 t0 -164.78 177.72 7.75 Favored 'General case' 0 CA--C 1.547 0.844 0 C-N-CA 131.31 3.844 . . . . 0.0 102.358 -179.448 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 50.4 m -147.51 119.9 8.43 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 119.367 -2.083 . . . . 0.0 106.426 -179.432 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -51.23 -30.11 16.42 Favored 'General case' 0 CA--C 1.536 0.428 0 N-CA-C 112.819 0.674 . . . . 0.0 112.819 -178.881 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 30.9 m -66.98 5.48 0.33 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.649 0 C-N-CA 126.267 1.827 . . . . 0.0 113.124 179.108 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 34.9 ttp85 -61.82 -7.8 4.09 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 125.317 1.447 . . . . 0.0 111.916 178.673 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -125.44 160.94 28.2 Favored 'General case' 0 C--O 1.234 0.245 0 C-N-CA 127.194 2.198 . . . . 0.0 106.148 177.612 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 29.7 pttt -141.99 110.92 6.25 Favored 'General case' 0 CA--C 1.52 -0.205 0 C-N-CA 123.178 0.591 . . . . 0.0 110.513 -179.121 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 9.1 p -80.08 -63.08 1.49 Allowed 'General case' 0 CA--C 1.532 0.27 0 N-CA-C 108.774 -0.824 . . . . 0.0 108.774 179.299 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 39.6 tt0 -61.44 149.28 39.06 Favored 'General case' 0 C--O 1.236 0.373 0 C-N-CA 125.018 1.327 . . . . 0.0 110.638 179.804 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 12.1 p -142.89 144.05 24.58 Favored 'Isoleucine or valine' 0 C--O 1.236 0.385 0 C-N-CA 126.274 1.829 . . . . 0.0 106.086 177.549 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -146.08 163.77 34.23 Favored 'General case' 0 CA--C 1.51 -0.562 0 N-CA-C 108.13 -1.063 . . . . 0.0 108.13 178.827 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 37.6 mm-40 -82.89 70.25 9.86 Favored 'General case' 0 CA--C 1.531 0.217 0 N-CA-C 107.005 -1.479 . . . . 0.0 107.005 178.936 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 16.0 ptmt -63.57 -38.64 91.9 Favored 'General case' 0 N--CA 1.457 -0.092 0 C-N-CA 127.384 2.274 . . . . 0.0 109.162 179.125 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 5.3 t -79.3 169.86 17.49 Favored 'General case' 0 N--CA 1.432 -1.364 0 C-N-CA 126.06 1.744 . . . . 0.0 108.457 179.163 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 16.0 t -101.77 157.61 4.46 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.578 0 N-CA-C 106.445 -1.687 . . . . 0.0 106.445 178.611 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 7.2 p -151.16 107.58 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 N-CA-C 105.723 -1.954 . . . . 0.0 105.723 178.05 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 4.2 ttt85 -152.66 146.63 25.31 Favored 'General case' 0 C--O 1.235 0.334 0 O-C-N 122.085 -0.385 . . . . 0.0 111.669 -178.954 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -76.97 119.03 20.14 Favored 'General case' 0 N--CA 1.449 -0.484 0 N-CA-C 104.739 -2.319 . . . . 0.0 104.739 177.212 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 13.0 tp -123.62 113.14 18.28 Favored 'General case' 0 N--CA 1.442 -0.835 0 C-N-CA 123.275 0.63 . . . . 0.0 109.371 179.788 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 7.7 mtm180 -98.31 162.24 13.28 Favored 'General case' 0 N--CA 1.453 -0.281 0 C-N-CA 125.629 1.572 . . . . 0.0 111.384 179.846 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 78.0 m-85 -144.24 150.99 38.81 Favored 'General case' 0 CA--C 1.53 0.208 0 C-N-CA 125.817 1.647 . . . . 0.0 107.004 179.421 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -75.26 175.43 4.08 Favored Pre-proline 0 CA--C 1.551 1.012 0 CA-C-N 119.83 1.195 . . . . 0.0 108.859 179.329 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 24' ' ' PRO . . . . . 0.491 ' HG3' ' HE3' ' B' ' 14' ' ' LYS . 43.6 Cg_endo -66.71 -43.38 7.43 Favored 'Trans proline' 0 C--N 1.35 0.634 0 CA-C-N 122.144 1.802 . . . . 0.0 113.067 -178.67 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 96.3 t -64.38 -41.71 93.17 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.218 0 N-CA-C 108.615 -0.883 . . . . 0.0 108.615 179.893 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -63.39 -47.75 80.73 Favored 'General case' 0 N--CA 1.452 -0.364 0 C-N-CA 123.664 0.785 . . . . 0.0 109.284 179.911 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 5.5 t70 -59.71 -49.91 75.91 Favored 'General case' 0 CA--C 1.507 -0.688 0 C-N-CA 125.837 1.655 . . . . 0.0 111.847 -179.898 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -62.29 -44.41 96.59 Favored 'General case' 0 N--CA 1.447 -0.613 0 N-CA-C 108.123 -1.066 . . . . 0.0 108.123 -179.64 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 30.8 m -61.17 -53.36 57.94 Favored 'General case' 0 N--CA 1.454 -0.265 0 N-CA-C 108.698 -0.852 . . . . 0.0 108.698 178.872 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 58.1 mt -58.16 -43.61 85.93 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.329 0 CA-C-N 119.038 0.835 . . . . 0.0 110.211 -179.644 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 23.2 ttt180 -63.22 -47.67 81.53 Favored 'General case' 0 C--N 1.332 -0.161 0 O-C-N 121.457 -0.777 . . . . 0.0 110.089 179.91 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 4.7 mptp? -63.71 -46.4 85.61 Favored 'General case' 0 C--O 1.225 -0.229 0 CA-C-N 118.82 0.736 . . . . 0.0 109.796 -179.786 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 13.5 mptt -64.82 -44.67 89.11 Favored 'General case' 0 CA--C 1.529 0.143 0 CA-C-O 118.057 -0.973 . . . . 0.0 110.237 -179.566 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -57.37 -56.14 25.67 Favored 'General case' 0 C--O 1.231 0.1 0 C-N-CA 124.656 1.183 . . . . 0.0 109.609 179.018 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 29.9 tt0 -60.63 -40.9 93.67 Favored 'General case' 0 N--CA 1.449 -0.488 0 C-N-CA 123.633 0.773 . . . . 0.0 112.132 -178.269 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 27.6 t70 -68.3 -30.27 69.22 Favored 'General case' 0 CA--C 1.53 0.173 0 C-N-CA 124.349 1.06 . . . . 0.0 110.138 179.449 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 10.1 t -82.18 -6.41 59.18 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 124.58 1.152 . . . . 0.0 109.375 178.153 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 69.2 29.27 72.12 Favored Glycine 0 CA--C 1.527 0.789 0 O-C-N 120.581 -1.325 . . . . 0.0 109.991 -179.265 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 75.9 mt -122.68 158.83 29.2 Favored 'General case' 0 N--CA 1.447 -0.597 0 C-N-CA 125.836 1.654 . . . . 0.0 108.137 179.99 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 40' ' ' THR . . . . . 0.427 HG23 ' H ' ' A' ' 43' ' ' ALA . 0.7 OUTLIER -84.91 147.49 26.73 Favored 'General case' 0 C--N 1.32 -0.704 0 N-CA-C 104.036 -2.579 . . . . 0.0 104.036 177.235 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 39.8 t -46.8 -41.05 5.06 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.478 0 C-N-CA 125.356 1.463 . . . . 0.0 110.241 178.494 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -60.75 -49.44 77.48 Favored 'General case' 0 CA--C 1.548 0.873 0 CA-C-N 119.622 1.101 . . . . 0.0 110.587 179.515 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.427 ' H ' HG23 ' A' ' 40' ' ' THR . . . -64.47 -41.84 96.26 Favored 'General case' 0 C--O 1.224 -0.261 0 C-N-CA 125.229 1.411 . . . . 0.0 110.203 178.898 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 81.3 t80 -58.35 -52.54 65.19 Favored 'General case' 0 N--CA 1.452 -0.347 0 N-CA-C 108.087 -1.079 . . . . 0.0 108.087 179.256 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.461 HG23 HG23 ' B' ' 45' ' ' ILE . 16.6 mm -52.44 -59.8 1.4 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.298 0 C-N-CA 124.227 1.011 . . . . 0.0 110.698 179.499 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 29.5 ptt180 -59.05 -44.17 91.76 Favored 'General case' 0 C--O 1.222 -0.381 0 CA-C-O 118.72 -0.657 . . . . 0.0 112.304 -178.944 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 29.4 t30 -59.91 -52.35 65.8 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-N 118.657 0.662 . . . . 0.0 110.808 -178.922 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -62.99 -29.21 70.64 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 123.649 0.78 . . . . 0.0 111.502 179.438 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -80.5 -15.41 56.77 Favored 'General case' 0 CA--C 1.532 0.283 0 N-CA-C 113.791 1.034 . . . . 0.0 113.791 -179.677 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 31.0 mt -101.96 -42.89 5.95 Favored 'General case' 0 CA--C 1.522 -0.131 0 CA-C-N 120.173 1.351 . . . . 0.0 112.124 -179.606 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 60.8 m-80 . . . . . 0 C--O 1.245 0.836 0 O-C-N 124.159 0.912 . . . . 0.0 109.487 -179.437 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 1' ' ' SER . . . . . . . . . . . . . 8.7 m . . . . . 0 N--CA 1.467 0.386 0 N-CA-C 107.748 -1.205 . . . . 0.0 107.748 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 2' ' ' ASP . . . . . . . . . . . . . 1.8 p-10 -153.19 -143.07 0.12 Allowed 'General case' 0 CA--C 1.542 0.656 0 N-CA-C 104.769 -2.308 . . . . 0.0 104.769 179.605 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 3' ' ' SER . . . . . . . . . . . . . 16.7 m -151.85 120.4 6.46 Favored 'General case' 0 N--CA 1.45 -0.429 0 CA-C-N 121.404 1.911 . . . . 0.0 107.415 179.013 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 4' ' ' ALA . . . . . . . . . . . . . . . -57.3 -32.38 66.59 Favored 'General case' 0 CA--C 1.538 0.495 0 O-C-N 121.851 -0.531 . . . . 0.0 110.919 179.352 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 30.5 m -69.52 12.59 0.12 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.722 0 C-N-CA 127.061 2.144 . . . . 0.0 112.535 179.062 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 6' ' ' ARG . . . . . . . . . . . . . 20.0 ttp85 -67.27 2.39 1.66 Allowed 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 126.998 2.119 . . . . 0.0 112.315 178.951 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -142.35 165.23 27.98 Favored 'General case' 0 C--O 1.239 0.538 0 C-N-CA 128.833 2.853 . . . . 0.0 104.424 178.029 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 16.8 pttt -141.71 111.63 6.73 Favored 'General case' 0 CA--C 1.519 -0.238 0 N-CA-C 113.314 0.857 . . . . 0.0 113.314 -178.315 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 5.3 p -70.08 -8.53 50.21 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 125.151 1.38 . . . . 0.0 110.856 178.328 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 10' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -145.84 157.9 43.89 Favored 'General case' 0 N--CA 1.444 -0.74 0 C-N-CA 124.486 1.115 . . . . 0.0 111.839 -178.701 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 11' ' ' VAL . . . . . . . . . . . . . 28.7 m -142.99 146.07 22.13 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 N-CA-C 103.75 -2.685 . . . . 0.0 103.75 177.569 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 12' ' ' ARG . . . . . . . . . . . . . 65.6 mtp85 -133.76 169.27 17.29 Favored 'General case' 0 C--O 1.245 0.822 0 N-CA-C 107.919 -1.141 . . . . 0.0 107.919 -179.46 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 13' ' ' GLN . . . . . . . . . . . . . 55.6 mm-40 -84.96 60.14 6.05 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 122.033 0.92 . . . . 0.0 109.017 178.69 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 14' ' ' LYS . . . . . 0.491 ' HE3' ' HG3' ' A' ' 24' ' ' PRO . 22.1 ptmt -61.22 -23.29 65.51 Favored 'General case' 0 C--O 1.223 -0.305 0 C-N-CA 125.611 1.564 . . . . 0.0 110.733 178.526 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 5.4 t -82.34 -171.17 3.3 Favored 'General case' 0 N--CA 1.436 -1.126 0 C-N-CA 125.072 1.349 . . . . 0.0 109.73 179.802 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 23.2 t -122.85 143.82 34.45 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.615 0 N-CA-C 105.537 -2.023 . . . . 0.0 105.537 179.234 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 6.4 p -143.74 97.66 0.58 Allowed 'Isoleucine or valine' 0 N--CA 1.443 -0.784 0 CA-C-O 122.471 1.129 . . . . 0.0 109.564 178.761 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 1.2 ttt85 -144.18 155.05 43.74 Favored 'General case' 0 N--CA 1.45 -0.463 0 CA-C-N 114.617 -1.174 . . . . 0.0 108.372 179.292 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -90.87 134.76 34.21 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 104.096 -2.557 . . . . 0.0 104.096 177.559 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 20' ' ' LEU . . . . . 0.407 ' HA ' HD12 ' B' ' 20' ' ' LEU . 11.3 tp -116.04 154.92 29.04 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-N 118.883 0.765 . . . . 0.0 109.673 179.497 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 18.4 mmt180 -126.54 150.28 48.89 Favored 'General case' 0 C--O 1.232 0.17 0 C-N-CA 125.762 1.625 . . . . 0.0 110.203 -178.93 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 22' ' ' PHE . . . . . . . . . . . . . 91.9 m-85 -145.82 143.91 29.94 Favored 'General case' 0 C--O 1.232 0.165 0 C-N-CA 125.587 1.555 . . . . 0.0 107.366 178.578 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 23' ' ' SER . . . . . 0.402 ' HB3' ' HD2' ' B' ' 24' ' ' PRO . 2.4 m -68.99 170.84 7.57 Favored Pre-proline 0 CA--C 1.542 0.652 0 CA-C-N 119.258 0.935 . . . . 0.0 109.997 179.323 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 24' ' ' PRO . . . . . 0.402 ' HD2' ' HB3' ' B' ' 23' ' ' SER . 36.8 Cg_endo -65.75 -44.81 7.43 Favored 'Trans proline' 0 C--N 1.349 0.584 0 C-N-CA 121.452 1.435 . . . . 0.0 113.139 -178.277 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 25' ' ' VAL . . . . . . . . . . . . . 21.8 t -65.87 -38.99 83.43 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.52 0 C-N-CA 123.918 0.887 . . . . 0.0 109.387 179.788 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 98.6 mt-10 -66.5 -40.93 89.52 Favored 'General case' 0 C--O 1.226 -0.173 0 C-N-CA 123.879 0.872 . . . . 0.0 108.858 179.488 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 27' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -62.89 -50.26 71.6 Favored 'General case' 0 CA--C 1.514 -0.412 0 C-N-CA 123.903 0.881 . . . . 0.0 109.518 179.195 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 28' ' ' GLU . . . . . . . . . . . . . 91.4 mt-10 -57.02 -43.35 81.78 Favored 'General case' 0 C--N 1.332 -0.191 0 C-N-CA 124.245 1.018 . . . . 0.0 109.542 178.689 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 80.0 m -63.23 -59.92 4.09 Favored 'General case' 0 N--CA 1.451 -0.421 0 N-CA-C 109.599 -0.519 . . . . 0.0 109.599 179.52 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 98.0 mt -58.09 -39.07 71.03 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.449 0 C-N-CA 123.961 0.904 . . . . 0.0 111.891 -178.686 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 24.1 ttt-85 -67.08 -48.4 68.34 Favored 'General case' 0 N--CA 1.453 -0.277 0 O-C-N 121.399 -0.813 . . . . 0.0 108.977 -179.855 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 2.1 mptp? -60.94 -46.98 88.52 Favored 'General case' 0 CA--C 1.515 -0.386 0 N-CA-C 108.82 -0.807 . . . . 0.0 108.82 -179.89 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 58.7 mmtt -63.59 -43.91 95.56 Favored 'General case' 0 C--O 1.22 -0.448 0 CA-C-O 118.053 -0.975 . . . . 0.0 110.619 -179.498 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 34' ' ' ALA . . . . . . . . . . . . . . . -58.21 -50.94 71.79 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 119.6 1.091 . . . . 0.0 109.237 178.618 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 27.6 tt0 -60.06 -45.03 94.23 Favored 'General case' 0 N--CA 1.454 -0.255 0 C-N-CA 124.144 0.977 . . . . 0.0 111.779 -179.185 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 36' ' ' ASP . . . . . . . . . . . . . 25.3 t0 -68.73 -37.53 79.53 Favored 'General case' 0 C--N 1.331 -0.215 0 C-N-CA 125.332 1.453 . . . . 0.0 110.418 -179.362 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 37' ' ' SER . . . . . . . . . . . . . 32.8 t -73.0 -11.2 60.48 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 126.409 1.884 . . . . 0.0 110.04 178.723 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 68.33 26.89 74.02 Favored Glycine 0 CA--C 1.525 0.689 0 O-C-N 121.246 -0.909 . . . . 0.0 111.259 -179.447 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 39' ' ' LEU . . . . . . . . . . . . . 82.2 mt -121.17 142.29 50.03 Favored 'General case' 0 N--CA 1.445 -0.678 0 C-N-CA 125.2 1.4 . . . . 0.0 107.588 -179.717 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 40' ' ' THR . . . . . . . . . . . . . 2.0 t -64.61 146.31 54.86 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 105.367 -2.086 . . . . 0.0 105.367 177.036 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 41' ' ' VAL . . . . . . . . . . . . . 2.2 t -45.94 -51.27 3.65 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.469 0 C-N-CA 124.748 1.219 . . . . 0.0 111.538 179.303 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 42' ' ' SER . . . . . . . . . . . . . 1.5 p -58.09 -31.54 67.21 Favored 'General case' 0 CA--C 1.544 0.741 0 O-C-N 120.325 -1.485 . . . . 0.0 112.686 -179.199 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -78.46 -40.8 34.57 Favored 'General case' 0 C--O 1.224 -0.256 0 C-N-CA 124.694 1.198 . . . . 0.0 109.047 177.71 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 44' ' ' TYR . . . . . . . . . . . . . 24.6 t80 -57.37 -51.85 67.74 Favored 'General case' 0 N--CA 1.455 -0.224 0 N-CA-C 108.409 -0.959 . . . . 0.0 108.409 179.442 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 45' ' ' ILE . . . . . 0.461 HG23 HG23 ' A' ' 45' ' ' ILE . 28.0 mm -54.16 -60.67 1.27 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.309 0 C-N-CA 123.358 0.663 . . . . 0.0 111.676 179.499 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 46' ' ' ARG . . . . . . . . . . . . . 9.9 ptt180 -56.48 -43.19 79.39 Favored 'General case' 0 C--O 1.224 -0.264 0 CA-C-O 119.171 -0.442 . . . . 0.0 111.23 -178.519 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 47' ' ' ASN . . . . . . . . . . . . . 39.0 t30 -60.41 -55.93 27.63 Favored 'General case' 0 N--CA 1.446 -0.642 0 C-N-CA 123.885 0.874 . . . . 0.0 111.944 -179.198 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -60.2 -33.33 72.09 Favored 'General case' 0 CA--C 1.53 0.185 0 O-C-N 124.17 0.919 . . . . 0.0 112.564 -179.069 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 49' ' ' ALA . . . . . . . . . . . . . . . -74.0 -24.33 59.57 Favored 'General case' 0 C--N 1.333 -0.145 0 N-CA-C 113.986 1.106 . . . . 0.0 113.986 -178.929 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 24.0 mt -100.19 -43.13 6.41 Favored 'General case' 0 CA--C 1.514 -0.407 0 N-CA-C 113.423 0.897 . . . . 0.0 113.423 -178.672 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 51' ' ' ASN . . . . . . . . . . . . . 26.6 m-80 . . . . . 0 C--O 1.249 1.062 0 C-N-CA 125.179 1.392 . . . . 0.0 107.649 -177.514 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 30.3 t . . . . . 0 N--CA 1.466 0.359 0 N-CA-C 104.068 -2.567 . . . . 0.0 104.068 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 11.7 p-10 -59.44 -41.46 89.68 Favored 'General case' 0 C--N 1.328 -0.344 0 C-N-CA 129.158 2.983 . . . . 0.0 109.471 177.662 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 13.9 t -153.11 -177.58 6.4 Favored 'General case' 0 N--CA 1.444 -0.751 0 C-N-CA 125.174 1.389 . . . . 0.0 109.432 -179.324 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -163.7 93.58 0.74 Allowed 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 128.346 2.658 . . . . 0.0 107.51 179.448 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 13.5 p -67.05 -30.03 48.15 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.699 0 O-C-N 121.613 -0.679 . . . . 0.0 111.694 179.697 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 48.7 ttt85 -67.54 149.36 50.25 Favored 'General case' 0 C--N 1.341 0.23 0 N-CA-C 108.174 -1.047 . . . . 0.0 108.174 179.497 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 1.7 pttm -137.01 173.74 11.37 Favored 'General case' 0 C--O 1.237 0.437 0 C-N-CA 123.855 0.862 . . . . 0.0 111.36 -178.223 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 53.6 mtmt -122.05 28.88 7.31 Favored 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 126.3 1.84 . . . . 0.0 111.413 -178.979 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 1.6 p -73.16 -16.17 61.44 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 124.617 1.167 . . . . 0.0 112.033 179.427 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 7.6 mt-10 -73.6 94.81 2.21 Favored 'General case' 0 C--N 1.34 0.176 0 C-N-CA 124.048 0.939 . . . . 0.0 109.023 -179.996 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.415 HG22 ' H ' ' A' ' 11' ' ' VAL . 6.1 m -67.85 -15.81 20.19 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 C-N-CA 126.238 1.815 . . . . 0.0 114.367 -179.882 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 4.9 tmm_? -61.49 130.89 48.21 Favored 'General case' 0 C--O 1.237 0.407 0 CA-C-N 119.974 1.261 . . . . 0.0 108.72 -179.637 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 23.5 mm100 -52.87 99.49 0.02 OUTLIER 'General case' 0 C--O 1.233 0.221 0 C-N-CA 125.757 1.623 . . . . 0.0 109.524 179.749 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 33.7 pttt -73.18 -24.55 60.56 Favored 'General case' 0 N--CA 1.463 0.193 0 C-N-CA 125.126 1.37 . . . . 0.0 111.847 -179.25 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 4.7 t -72.15 -174.89 1.36 Allowed 'General case' 0 N--CA 1.446 -0.635 0 N-CA-C 107.266 -1.383 . . . . 0.0 107.266 177.835 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 13.5 t -131.32 157.98 43.26 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 N-CA-C 106.01 -1.848 . . . . 0.0 106.01 -179.673 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 13.6 p -149.16 116.98 0.9 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.444 0 N-CA-C 106.881 -1.525 . . . . 0.0 106.881 178.898 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 25.1 ttt180 -153.26 161.22 42.63 Favored 'General case' 0 N--CA 1.466 0.339 0 O-C-N 121.691 -0.631 . . . . 0.0 110.153 -179.847 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -106.32 127.79 53.51 Favored 'General case' 0 C--O 1.24 0.58 0 N-CA-C 105.052 -2.203 . . . . 0.0 105.052 179.102 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -128.24 120.31 26.92 Favored 'General case' 0 CA--C 1.529 0.162 0 C-N-CA 124.284 1.034 . . . . 0.0 109.602 -178.448 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 15.6 mmt85 -83.84 156.97 22.2 Favored 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 124.811 1.244 . . . . 0.0 110.665 -179.768 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 70.6 m-85 -144.61 155.31 43.56 Favored 'General case' 0 N--CA 1.463 0.224 0 C-N-CA 125.355 1.462 . . . . 0.0 108.315 178.55 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' SER . . . . . 0.457 ' HB3' ' HD2' ' A' ' 24' ' ' PRO . 39.1 m -79.9 171.08 13.34 Favored Pre-proline 0 CA--C 1.545 0.783 0 C-N-CA 123.976 0.91 . . . . 0.0 108.904 179.095 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 24' ' ' PRO . . . . . 0.457 ' HD2' ' HB3' ' A' ' 23' ' ' SER . 35.0 Cg_endo -64.75 -54.61 0.68 Allowed 'Trans proline' 0 C--N 1.351 0.674 0 C-N-CA 121.961 1.774 . . . . 0.0 112.027 -178.012 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 33.7 t -58.91 -42.02 84.68 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.337 0 C-N-CA 123.359 0.664 . . . . 0.0 110.013 -179.716 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -63.55 -50.24 70.29 Favored 'General case' 0 C--O 1.227 -0.092 0 C-N-CA 123.289 0.635 . . . . 0.0 110.856 -179.576 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 7.1 t70 -59.65 -47.04 87.18 Favored 'General case' 0 C--O 1.221 -0.398 0 C-N-CA 123.859 0.864 . . . . 0.0 110.224 179.218 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 44.8 tt0 -58.18 -44.71 88.15 Favored 'General case' 0 N--CA 1.449 -0.523 0 C-N-CA 124.628 1.171 . . . . 0.0 109.217 179.945 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 68.7 m -60.42 -52.18 66.32 Favored 'General case' 0 CA--C 1.538 0.51 0 N-CA-C 108.793 -0.818 . . . . 0.0 108.793 178.886 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 72.3 mt -59.26 -45.99 92.63 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.211 0 C-N-CA 123.379 0.672 . . . . 0.0 109.752 -179.684 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 62.8 ttt180 -61.06 -40.98 95.7 Favored 'General case' 0 C--O 1.234 0.255 0 C-N-CA 124.237 1.015 . . . . 0.0 110.308 -179.525 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -68.34 -52.65 31.0 Favored 'General case' 0 CA--C 1.52 -0.201 0 CA-C-N 118.644 0.656 . . . . 0.0 110.33 179.461 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 75.9 mttt -60.99 -43.44 98.85 Favored 'General case' 0 CA--C 1.518 -0.262 0 CA-C-N 119.021 0.828 . . . . 0.0 111.122 -178.584 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -56.82 -54.16 49.64 Favored 'General case' 0 N--CA 1.452 -0.337 0 C-N-CA 123.936 0.894 . . . . 0.0 109.477 179.235 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 31.3 tt0 -62.82 -41.46 99.33 Favored 'General case' 0 N--CA 1.455 -0.185 0 N-CA-C 112.908 0.707 . . . . 0.0 112.908 -178.516 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -62.95 -39.3 94.22 Favored 'General case' 0 N--CA 1.453 -0.309 0 C-N-CA 125.451 1.501 . . . . 0.0 108.574 179.449 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 8.7 t -78.89 -9.76 59.59 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 123.815 0.846 . . . . 0.0 109.967 177.776 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 64.71 27.08 71.51 Favored Glycine 0 N--CA 1.442 -0.928 0 C-N-CA 125.955 1.74 . . . . 0.0 112.078 -179.458 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 13.3 mt -118.3 138.1 52.61 Favored 'General case' 0 CA--C 1.518 -0.287 0 N-CA-C 103.851 -2.648 . . . . 0.0 103.851 179.292 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 40' ' ' THR . . . . . 0.453 HG23 ' H ' ' A' ' 43' ' ' ALA . 5.5 t -56.4 151.85 12.4 Favored 'General case' 0 CA--C 1.534 0.333 0 N-CA-C 108.968 -0.753 . . . . 0.0 108.968 178.942 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 24.4 t -52.14 -37.1 21.57 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.363 0 N-CA-C 109.106 -0.702 . . . . 0.0 109.106 177.865 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 12.2 m -62.09 -30.46 71.02 Favored 'General case' 0 CA--C 1.541 0.605 0 O-C-N 121.138 -0.976 . . . . 0.0 112.646 179.893 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.453 ' H ' HG23 ' A' ' 40' ' ' THR . . . -81.82 -46.51 14.07 Favored 'General case' 0 CA--C 1.516 -0.356 0 N-CA-C 106.535 -1.654 . . . . 0.0 106.535 177.852 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 82.0 t80 -51.39 -52.68 43.71 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 124.091 0.956 . . . . 0.0 109.327 -179.684 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 13.1 mm -53.0 -64.01 0.43 Allowed 'Isoleucine or valine' 0 C--N 1.34 0.173 0 C-N-CA 126.079 1.752 . . . . 0.0 110.801 179.479 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -54.61 -47.95 72.78 Favored 'General case' 0 C--O 1.22 -0.487 0 CA-C-O 119.133 -0.461 . . . . 0.0 111.305 -178.2 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 11.3 t30 -58.76 -49.79 76.35 Favored 'General case' 0 N--CA 1.445 -0.713 0 C-N-CA 123.455 0.702 . . . . 0.0 112.427 -178.877 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -64.98 -31.97 73.46 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 123.388 0.675 . . . . 0.0 111.146 179.337 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -75.86 -35.65 59.85 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 124.156 0.982 . . . . 0.0 113.05 -179.742 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.454 HD21 ' HA ' ' B' ' 26' ' ' GLU . 22.5 mt -77.54 -44.56 28.18 Favored 'General case' 0 CA--C 1.515 -0.398 0 N-CA-C 113.817 1.043 . . . . 0.0 113.817 -177.81 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 57.9 m-80 . . . . . 0 C--O 1.249 1.047 0 CA-C-O 117.774 -1.108 . . . . 0.0 111.233 179.632 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 1' ' ' SER . . . . . . . . . . . . . 12.8 t . . . . . 0 N--CA 1.466 0.356 0 N-CA-C 104.426 -2.435 . . . . 0.0 104.426 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 2' ' ' ASP . . . . . . . . . . . . . 7.7 p-10 -54.34 -37.77 65.27 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 128.581 2.753 . . . . 0.0 107.76 176.732 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 3' ' ' SER . . . . . . . . . . . . . 22.7 t -145.51 177.36 8.92 Favored 'General case' 0 N--CA 1.435 -1.182 0 C-N-CA 128.745 2.818 . . . . 0.0 105.925 178.874 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 4' ' ' ALA . . . . . . . . . . . . . . . -175.81 88.98 0.04 OUTLIER 'General case' 0 N--CA 1.452 -0.354 0 C-N-CA 126.49 1.916 . . . . 0.0 107.387 179.456 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 12.9 p -57.88 -22.04 17.91 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.66 0 C-N-CA 124.48 1.112 . . . . 0.0 113.388 -179.74 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 6' ' ' ARG . . . . . . . . . . . . . 30.0 ttt180 -63.0 149.31 45.26 Favored 'General case' 0 CA--C 1.536 0.414 0 O-C-N 121.245 -0.909 . . . . 0.0 109.778 179.786 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -139.26 -173.36 3.57 Favored 'General case' 0 C--O 1.237 0.407 0 C-N-CA 124.591 1.156 . . . . 0.0 108.988 179.347 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 46.0 mtmt -133.93 40.74 3.06 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 124.167 0.987 . . . . 0.0 111.39 -178.309 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 1.7 p -68.42 -8.9 44.71 Favored 'General case' 0 CA--C 1.538 0.517 0 N-CA-C 114.302 1.223 . . . . 0.0 114.302 -179.736 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 10' ' ' GLU . . . . . . . . . . . . . 19.1 mp0 -83.8 78.57 9.69 Favored 'General case' 0 N--CA 1.45 -0.445 0 C-N-CA 125.118 1.367 . . . . 0.0 110.231 -177.936 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 11' ' ' VAL . . . . . . . . . . . . . 27.0 m -66.54 -8.16 6.84 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.565 0 C-N-CA 125.111 1.364 . . . . 0.0 113.405 179.869 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 12' ' ' ARG . . . . . . . . . . . . . 4.4 tmm_? -64.47 153.36 39.11 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-N 119.578 1.081 . . . . 0.0 108.462 179.452 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 13' ' ' GLN . . . . . . . . . . . . . 28.4 mm100 -60.05 110.35 1.18 Allowed 'General case' 0 C--O 1.231 0.114 0 N-CA-C 109.532 -0.544 . . . . 0.0 109.532 179.326 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 33.8 pttt -85.61 -27.16 25.64 Favored 'General case' 0 C--N 1.331 -0.209 0 C-N-CA 123.197 0.599 . . . . 0.0 110.033 179.128 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 2.9 t -74.54 -168.96 0.76 Allowed 'General case' 0 N--CA 1.445 -0.713 0 N-CA-C 107.391 -1.337 . . . . 0.0 107.391 178.088 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 2.9 t -141.02 154.54 21.1 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.719 0 N-CA-C 106.432 -1.692 . . . . 0.0 106.432 179.24 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 14.0 p -141.53 114.51 4.37 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.646 0 N-CA-C 106.725 -1.583 . . . . 0.0 106.725 178.579 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 7.9 ttt180 -149.26 148.56 29.71 Favored 'General case' 0 N--CA 1.47 0.553 0 N-CA-C 108.166 -1.05 . . . . 0.0 108.166 178.691 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 2.6 m -101.2 116.66 33.33 Favored 'General case' 0 C--O 1.236 0.376 0 N-CA-C 107.982 -1.118 . . . . 0.0 107.982 -179.614 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -115.28 159.96 20.36 Favored 'General case' 0 C--O 1.235 0.296 0 C-N-CA 124.412 1.085 . . . . 0.0 109.97 -179.508 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 1.5 mtt85 -125.99 162.9 24.19 Favored 'General case' 0 N--CA 1.443 -0.787 0 C-N-CA 124.711 1.204 . . . . 0.0 110.721 178.439 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 22' ' ' PHE . . . . . . . . . . . . . 92.9 m-85 -140.65 146.66 38.18 Favored 'General case' 0 N--CA 1.454 -0.27 0 C-N-CA 124.985 1.314 . . . . 0.0 107.996 179.749 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 14.8 m -73.91 168.75 23.06 Favored Pre-proline 0 CA--C 1.548 0.887 0 N-CA-C 106.714 -1.587 . . . . 0.0 106.714 178.276 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 24' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_endo -63.0 -44.27 16.41 Favored 'Trans proline' 0 N--CA 1.459 -0.523 0 C-N-CA 121.456 1.437 . . . . 0.0 112.825 -178.112 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 25' ' ' VAL . . . . . . . . . . . . . 75.1 t -64.87 -40.22 88.33 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.276 0 C-N-CA 123.894 0.878 . . . . 0.0 110.168 179.609 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 26' ' ' GLU . . . . . 0.454 ' HA ' HD21 ' A' ' 50' ' ' LEU . 81.9 mt-10 -62.76 -51.05 68.66 Favored 'General case' 0 N--CA 1.453 -0.316 0 N-CA-C 109.494 -0.558 . . . . 0.0 109.494 -179.343 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 27' ' ' ASP . . . . . . . . . . . . . 17.7 t70 -59.28 -47.48 85.2 Favored 'General case' 0 CA--C 1.511 -0.543 0 C-N-CA 125.165 1.386 . . . . 0.0 111.428 179.875 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 28' ' ' GLU . . . . . . . . . . . . . 73.2 tt0 -57.6 -46.91 83.46 Favored 'General case' 0 N--CA 1.447 -0.594 0 C-N-CA 124.589 1.156 . . . . 0.0 109.108 179.421 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 55.9 m -61.82 -57.86 10.22 Favored 'General case' 0 CA--C 1.533 0.323 0 N-CA-C 109.618 -0.512 . . . . 0.0 109.618 179.067 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 90.2 mt -53.92 -46.13 64.19 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.1 0 C-N-CA 123.539 0.736 . . . . 0.0 110.671 -178.066 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 63.0 ttt180 -61.14 -47.92 83.98 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-O 118.688 -0.672 . . . . 0.0 110.72 -179.665 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -65.24 -46.32 81.04 Favored 'General case' 0 CA--C 1.517 -0.302 0 CA-C-O 118.617 -0.706 . . . . 0.0 110.214 -179.073 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 65.1 mttt -59.22 -47.82 83.93 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-N 118.935 0.789 . . . . 0.0 110.276 -179.497 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 34' ' ' ALA . . . . . . . . . . . . . . . -57.86 -56.45 21.82 Favored 'General case' 0 N--CA 1.45 -0.457 0 C-N-CA 124.229 1.011 . . . . 0.0 110.248 179.802 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 17.4 tt0 -62.94 -34.6 77.82 Favored 'General case' 0 C--N 1.33 -0.253 0 C-N-CA 123.796 0.839 . . . . 0.0 112.783 -177.681 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 36' ' ' ASP . . . . . . . . . . . . . 5.3 t70 -67.94 -42.36 81.12 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 108.263 -1.014 . . . . 0.0 108.263 178.715 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 37' ' ' SER . . . . . . . . . . . . . 31.8 t -71.98 -27.0 62.47 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-O 121.244 0.545 . . . . 0.0 109.861 179.412 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 97.72 -4.05 61.26 Favored Glycine 0 CA--C 1.523 0.541 0 C-N-CA 125.203 1.382 . . . . 0.0 111.877 -179.712 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 39' ' ' LEU . . . . . . . . . . . . . 31.8 mt -87.85 144.29 26.67 Favored 'General case' 0 N--CA 1.438 -1.038 0 C-N-CA 125.255 1.422 . . . . 0.0 107.168 -179.959 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 40' ' ' THR . . . . . . . . . . . . . 1.8 t -68.39 147.25 52.35 Favored 'General case' 0 C--N 1.313 -0.988 0 N-CA-C 106.039 -1.837 . . . . 0.0 106.039 177.56 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 41' ' ' VAL . . . . . . . . . . . . . 53.7 t -49.88 -38.26 13.77 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.446 0 O-C-N 121.524 -0.735 . . . . 0.0 110.926 179.144 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 42' ' ' SER . . . . . . . . . . . . . 14.1 p -61.67 -37.78 85.33 Favored 'General case' 0 CA--C 1.533 0.327 0 O-C-N 121.071 -1.018 . . . . 0.0 111.836 179.651 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -73.73 -43.3 59.54 Favored 'General case' 0 C--N 1.341 0.211 0 C-N-CA 125.802 1.641 . . . . 0.0 108.3 178.492 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 44' ' ' TYR . . . . . . . . . . . . . 47.2 t80 -56.08 -50.01 72.2 Favored 'General case' 0 N--CA 1.451 -0.378 0 C-N-CA 123.721 0.809 . . . . 0.0 109.323 179.489 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 45' ' ' ILE . . . . . . . . . . . . . 12.8 mm -52.56 -63.93 0.43 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.291 0 C-N-CA 124.786 1.235 . . . . 0.0 110.727 179.765 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 46' ' ' ARG . . . . . . . . . . . . . 15.2 ptp180 -55.36 -48.06 74.83 Favored 'General case' 0 C--O 1.226 -0.161 0 C-N-CA 123.602 0.761 . . . . 0.0 112.081 -179.5 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 47' ' ' ASN . . . . . . . . . . . . . 29.9 t30 -59.42 -53.17 61.19 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-O 118.717 -0.659 . . . . 0.0 111.141 -179.347 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -63.28 -32.76 74.26 Favored 'General case' 0 C--O 1.224 -0.24 0 C-N-CA 123.753 0.821 . . . . 0.0 112.283 -179.574 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 49' ' ' ALA . . . . . . . . . . . . . . . -68.62 -37.03 79.42 Favored 'General case' 0 C--O 1.232 0.167 0 O-C-N 121.758 -0.589 . . . . 0.0 111.145 179.931 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 21.4 mt -79.8 -41.36 26.62 Favored 'General case' 0 CA--C 1.521 -0.147 0 CA-C-O 119.1 -0.476 . . . . 0.0 110.439 -179.687 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 51' ' ' ASN . . . . . . . . . . . . . 57.5 m-80 . . . . . 0 C--O 1.253 1.286 0 C-N-CA 124.335 1.054 . . . . 0.0 111.295 -178.492 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 32.6 m . . . . . 0 N--CA 1.482 1.163 0 N-CA-C 104.464 -2.421 . . . . 0.0 104.464 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -124.86 -13.65 6.86 Favored 'General case' 0 C--N 1.321 -0.644 0 C-N-CA 127.865 2.466 . . . . 0.0 113.045 -172.701 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 26.5 t -73.19 117.81 15.38 Favored 'General case' 0 CA--C 1.532 0.251 0 N-CA-C 108.509 -0.923 . . . . 0.0 108.509 179.157 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -97.87 -13.1 21.44 Favored 'General case' 0 CA--C 1.536 0.441 0 N-CA-C 113.33 0.863 . . . . 0.0 113.33 -179.926 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 2.6 t 37.38 44.53 0.25 Allowed 'Isoleucine or valine' 0 CA--C 1.547 0.861 0 C-N-CA 128.138 2.575 . . . . 0.0 112.9 -179.733 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 9.6 mmp_? -68.54 132.49 47.04 Favored 'General case' 0 C--O 1.234 0.26 0 N-CA-C 107.206 -1.405 . . . . 0.0 107.206 179.889 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 38.4 tttm -141.51 -18.94 0.77 Allowed 'General case' 0 N--CA 1.465 0.318 0 C-N-CA 123.611 0.765 . . . . 0.0 112.455 179.936 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 35.7 pttt -157.83 86.14 0.91 Allowed 'General case' 0 C--N 1.332 -0.187 0 N-CA-C 106.296 -1.742 . . . . 0.0 106.296 179.296 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 18.5 m -53.57 -45.27 69.88 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 123.479 0.712 . . . . 0.0 109.484 -179.765 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 37.6 mt-10 -153.87 160.17 42.06 Favored 'General case' 0 N--CA 1.452 -0.351 0 C-N-CA 126.115 1.766 . . . . 0.0 107.189 178.782 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 2.7 t -144.98 103.82 0.69 Allowed 'Isoleucine or valine' 0 N--CA 1.457 -0.089 0 N-CA-C 105.714 -1.958 . . . . 0.0 105.714 178.635 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 47.4 mtp180 -52.26 -52.62 51.56 Favored 'General case' 0 N--CA 1.467 0.395 0 C-N-CA 124.113 0.965 . . . . 0.0 109.085 -179.578 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 14.4 pt20 -120.28 85.24 2.35 Favored 'General case' 0 N--CA 1.447 -0.594 0 C-N-CA 126.215 1.806 . . . . 0.0 108.003 179.74 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 21.5 ptmt -65.48 -35.79 81.94 Favored 'General case' 0 C--O 1.222 -0.372 0 CA-C-N 115.588 -0.733 . . . . 0.0 111.382 179.457 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 4.0 t -81.59 167.29 19.41 Favored 'General case' 0 N--CA 1.446 -0.637 0 C-N-CA 123.97 0.908 . . . . 0.0 108.883 178.778 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 2.4 t -119.05 156.48 21.12 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 C-N-CA 125.954 1.701 . . . . 0.0 106.623 178.485 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 14.8 p -144.47 123.47 6.72 Favored 'Isoleucine or valine' 0 C--O 1.238 0.499 0 N-CA-C 106.73 -1.582 . . . . 0.0 106.73 178.928 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 13.7 ttm180 -154.51 164.92 37.95 Favored 'General case' 0 C--O 1.234 0.266 0 O-C-N 121.674 -0.641 . . . . 0.0 109.516 179.416 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 3.8 m -107.84 135.32 49.44 Favored 'General case' 0 N--CA 1.448 -0.542 0 N-CA-C 105.327 -2.101 . . . . 0.0 105.327 178.721 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 43.9 mt -129.91 108.76 10.37 Favored 'General case' 0 CA--C 1.512 -0.513 0 N-CA-C 108.584 -0.895 . . . . 0.0 108.584 179.293 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -77.86 150.32 34.19 Favored 'General case' 0 N--CA 1.45 -0.462 0 N-CA-C 107.213 -1.403 . . . . 0.0 107.213 177.555 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 66.6 m-85 -144.02 161.74 38.0 Favored 'General case' 0 C--O 1.237 0.433 0 N-CA-C 106.508 -1.664 . . . . 0.0 106.508 178.185 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' SER . . . . . 0.413 ' HB3' ' HD2' ' A' ' 24' ' ' PRO . 36.7 m -92.71 167.6 14.21 Favored Pre-proline 0 CA--C 1.538 0.483 0 C-N-CA 124.58 1.152 . . . . 0.0 109.407 179.453 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 24' ' ' PRO . . . . . 0.413 ' HD2' ' HB3' ' A' ' 23' ' ' SER . 55.4 Cg_endo -63.01 -29.81 75.82 Favored 'Trans proline' 0 C--N 1.347 0.45 0 C-N-CA 122.861 2.374 . . . . 0.0 113.306 -178.808 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 71.6 t -68.63 -54.61 19.99 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.455 0 N-CA-C 107.381 -1.34 . . . . 0.0 107.381 179.134 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 28.0 mt-10 -59.45 -44.08 93.04 Favored 'General case' 0 C--O 1.223 -0.302 0 C-N-CA 125.231 1.412 . . . . 0.0 110.58 179.964 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -62.13 -48.54 79.69 Favored 'General case' 0 CA--C 1.512 -0.489 0 C-N-CA 125.667 1.587 . . . . 0.0 110.919 179.984 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 76.7 tt0 -59.69 -42.4 92.89 Favored 'General case' 0 N--CA 1.453 -0.284 0 N-CA-C 108.509 -0.923 . . . . 0.0 108.509 178.486 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 18.8 m -62.26 -60.31 3.77 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 123.461 0.704 . . . . 0.0 109.559 -179.932 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 96.5 mt -57.87 -39.54 71.83 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.163 0 C-N-CA 124.195 0.998 . . . . 0.0 111.064 -178.965 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 19.8 ttt180 -69.36 -37.11 77.46 Favored 'General case' 0 C--N 1.332 -0.186 0 O-C-N 120.907 -1.12 . . . . 0.0 110.675 -179.81 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 2.2 mptp? -70.15 -49.24 52.55 Favored 'General case' 0 CA--C 1.517 -0.29 0 N-CA-C 109.385 -0.598 . . . . 0.0 109.385 178.973 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 3.2 mptp? -63.81 -46.48 84.97 Favored 'General case' 0 CA--C 1.511 -0.521 0 C-N-CA 124.478 1.111 . . . . 0.0 110.682 -178.462 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -59.27 -53.96 52.3 Favored 'General case' 0 N--CA 1.452 -0.368 0 CA-C-N 119.137 0.881 . . . . 0.0 109.794 179.611 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 41.9 tt0 -62.45 -38.06 88.3 Favored 'General case' 0 CA--C 1.532 0.282 0 N-CA-C 112.011 0.374 . . . . 0.0 112.011 -178.099 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 31.6 t70 -69.64 -37.95 76.97 Favored 'General case' 0 C--O 1.233 0.228 0 C-N-CA 123.535 0.734 . . . . 0.0 109.878 179.194 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 10.4 t -72.37 -8.04 52.84 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 124.224 1.01 . . . . 0.0 108.639 177.802 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 71.03 6.72 60.99 Favored Glycine 0 C--N 1.341 0.86 0 C-N-CA 126.098 1.808 . . . . 0.0 113.108 -179.488 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 15.3 mt -101.66 161.05 13.93 Favored 'General case' 0 N--CA 1.441 -0.888 0 C-N-CA 126.161 1.784 . . . . 0.0 107.127 -179.491 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' THR . . . . . 0.496 HG23 ' H ' ' A' ' 43' ' ' ALA . 5.1 t -81.04 155.16 26.48 Favored 'General case' 0 C--N 1.313 -1.012 0 O-C-N 120.42 -1.425 . . . . 0.0 107.641 178.781 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 20.8 t -51.65 -39.75 24.41 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.407 0 C-N-CA 124.87 1.268 . . . . 0.0 110.099 178.659 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 15.2 p -61.44 -50.46 72.7 Favored 'General case' 0 CA--C 1.534 0.35 0 O-C-N 121.907 -0.496 . . . . 0.0 109.987 179.303 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.496 ' H ' HG23 ' A' ' 40' ' ' THR . . . -59.86 -48.84 80.05 Favored 'General case' 0 CA--C 1.519 -0.217 0 C-N-CA 125.737 1.615 . . . . 0.0 109.959 178.997 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 81.9 t80 -51.14 -49.56 60.61 Favored 'General case' 0 N--CA 1.45 -0.47 0 C-N-CA 124.814 1.246 . . . . 0.0 109.803 -179.873 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 13.9 mm -57.67 -65.01 0.46 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.394 0 C-N-CA 124.067 0.947 . . . . 0.0 110.62 179.373 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 7.2 ptp180 -53.81 -41.65 67.54 Favored 'General case' 0 C--N 1.341 0.198 0 CA-C-O 117.886 -1.054 . . . . 0.0 111.906 -178.424 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 28.9 t30 -61.88 -55.89 25.02 Favored 'General case' 0 N--CA 1.453 -0.312 0 C-N-CA 124.014 0.926 . . . . 0.0 110.127 179.68 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -61.5 -29.55 70.05 Favored 'General case' 0 C--O 1.224 -0.248 0 C-N-CA 123.176 0.59 . . . . 0.0 112.288 -179.133 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -77.6 -26.38 50.62 Favored 'General case' 0 N--CA 1.451 -0.412 0 N-CA-C 113.148 0.796 . . . . 0.0 113.148 179.885 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 18.5 mt -88.92 -42.69 11.67 Favored 'General case' 0 CA--C 1.514 -0.413 0 O-C-N 121.031 -1.043 . . . . 0.0 109.346 -179.679 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 5.5 m-80 . . . . . 0 C--O 1.242 0.683 0 O-C-N 124.628 1.205 . . . . 0.0 107.883 179.461 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 1' ' ' SER . . . . . . . . . . . . . 30.2 m . . . . . 0 N--CA 1.482 1.132 0 N-CA-C 103.708 -2.701 . . . . 0.0 103.708 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 2' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -127.16 -11.96 5.8 Favored 'General case' 0 N--CA 1.447 -0.596 0 CA-C-N 112.915 -1.948 . . . . 0.0 114.144 -172.08 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 3' ' ' SER . . . . . . . . . . . . . 19.0 t -71.41 118.35 14.11 Favored 'General case' 0 N--CA 1.453 -0.296 0 N-CA-C 106.712 -1.588 . . . . 0.0 106.712 178.903 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 4' ' ' ALA . . . . . . . . . . . . . . . -71.44 -15.39 62.34 Favored 'General case' 0 CA--C 1.537 0.479 0 N-CA-C 113.327 0.862 . . . . 0.0 113.327 -179.778 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 3.5 t 43.25 48.35 0.37 Allowed 'Isoleucine or valine' 0 CA--C 1.546 0.824 0 C-N-CA 126.994 2.118 . . . . 0.0 112.319 -179.326 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 6' ' ' ARG . . . . . . . . . . . . . 15.6 mmp_? -98.92 148.85 23.54 Favored 'General case' 0 N--CA 1.464 0.229 0 O-C-N 120.351 -1.468 . . . . 0.0 107.319 178.613 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 36.5 tttm -154.12 -34.32 0.1 Allowed 'General case' 0 N--CA 1.465 0.32 0 C-N-CA 123.957 0.903 . . . . 0.0 111.868 -179.63 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 95.6 mttt -141.5 94.2 2.66 Favored 'General case' 0 N--CA 1.457 -0.093 0 N-CA-C 103.237 -2.875 . . . . 0.0 103.237 179.102 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 6.4 m -57.85 -58.74 7.04 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 119.34 0.973 . . . . 0.0 108.4 -179.439 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 10' ' ' GLU . . . . . . . . . . . . . 5.1 pm0 -137.54 162.25 34.24 Favored 'General case' 0 N--CA 1.452 -0.35 0 C-N-CA 125.301 1.44 . . . . 0.0 107.937 179.084 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 11' ' ' VAL . . . . . . . . . . . . . 68.6 t -146.11 123.57 4.15 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.337 0 N-CA-C 108.093 -1.077 . . . . 0.0 108.093 -179.948 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 12' ' ' ARG . . . . . . . . . . . . . 17.5 mtp180 -67.92 -57.69 5.79 Favored 'General case' 0 N--CA 1.468 0.43 0 C-N-CA 123.804 0.842 . . . . 0.0 110.234 -179.741 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 13' ' ' GLN . . . . . . . . . . . . . 72.4 mt-30 -120.3 90.44 3.33 Favored 'General case' 0 C--O 1.235 0.319 0 C-N-CA 125.453 1.501 . . . . 0.0 107.179 -179.528 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 17.5 ptmt -66.54 -33.29 75.36 Favored 'General case' 0 C--N 1.333 -0.138 0 C-N-CA 123.567 0.747 . . . . 0.0 111.159 179.683 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 1.3 t -74.48 176.08 7.16 Favored 'General case' 0 N--CA 1.443 -0.784 0 CA-C-O 122.152 0.977 . . . . 0.0 110.923 -179.768 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 41.0 t -117.76 146.66 21.94 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 C-N-CA 126.813 2.045 . . . . 0.0 105.902 179.02 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 7.2 p -146.07 107.76 0.77 Allowed 'Isoleucine or valine' 0 N--CA 1.451 -0.418 0 N-CA-C 105.343 -2.095 . . . . 0.0 105.343 178.326 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 9.8 ttt180 -149.52 166.43 29.21 Favored 'General case' 0 CA--C 1.509 -0.633 0 N-CA-C 109.978 -0.378 . . . . 0.0 109.978 -179.739 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 19.2 m -105.49 145.7 30.54 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 108.282 -1.007 . . . . 0.0 108.282 179.699 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 26.7 mt -135.5 143.5 45.84 Favored 'General case' 0 N--CA 1.443 -0.816 0 N-CA-C 106.481 -1.674 . . . . 0.0 106.481 177.405 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -114.91 143.2 45.52 Favored 'General case' 0 N--CA 1.448 -0.526 0 N-CA-C 105.434 -2.061 . . . . 0.0 105.434 178.976 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 22' ' ' PHE . . . . . . . . . . . . . 95.8 m-85 -136.46 140.98 43.5 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 106.145 -1.798 . . . . 0.0 106.145 179.632 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 4.6 m -74.87 169.08 21.76 Favored Pre-proline 0 CA--C 1.543 0.699 0 C-N-CA 123.33 0.652 . . . . 0.0 109.272 179.802 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 24' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo -67.06 -28.92 40.85 Favored 'Trans proline' 0 C--N 1.348 0.525 0 C-N-CA 122.025 1.817 . . . . 0.0 113.573 -178.294 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 25' ' ' VAL . . . . . . . . . . . . . 46.8 t -74.51 -48.34 35.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 N-CA-C 107.38 -1.341 . . . . 0.0 107.38 -179.666 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 26.8 mp0 -59.51 -43.28 93.42 Favored 'General case' 0 N--CA 1.448 -0.566 0 C-N-CA 125.071 1.348 . . . . 0.0 109.206 179.181 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 27' ' ' ASP . . . . . . . . . . . . . 19.3 t70 -63.65 -50.27 69.96 Favored 'General case' 0 C--O 1.224 -0.246 0 C-N-CA 124.252 1.021 . . . . 0.0 109.84 179.136 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 28' ' ' GLU . . . . . . . . . . . . . 64.1 tt0 -60.89 -17.21 49.33 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 125.138 1.375 . . . . 0.0 110.915 179.254 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 27.2 m -91.92 -61.44 1.63 Allowed 'General case' 0 N--CA 1.453 -0.317 0 N-CA-C 107.671 -1.233 . . . . 0.0 107.671 178.427 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 96.4 mt -58.17 -29.34 36.86 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.484 0 C-N-CA 124.109 0.964 . . . . 0.0 112.462 -178.388 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 61.8 ttt180 -73.58 -32.19 64.0 Favored 'General case' 0 C--N 1.328 -0.355 0 O-C-N 120.358 -1.464 . . . . 0.0 110.185 -179.959 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 3.7 mptp? -81.03 -50.51 9.58 Favored 'General case' 0 N--CA 1.456 -0.135 0 C-N-CA 123.584 0.754 . . . . 0.0 112.274 -179.475 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 4.6 mptp? -61.15 -42.06 97.88 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-O 118.95 -0.547 . . . . 0.0 110.785 -177.847 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 34' ' ' ALA . . . . . . . . . . . . . . . -60.1 -54.55 44.56 Favored 'General case' 0 N--CA 1.455 -0.213 0 C-N-CA 124.155 0.982 . . . . 0.0 108.794 179.614 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 16.4 tt0 -61.14 -36.38 79.63 Favored 'General case' 0 CA--C 1.532 0.273 0 N-CA-C 112.435 0.532 . . . . 0.0 112.435 -178.522 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 36' ' ' ASP . . . . . . . . . . . . . 5.8 t70 -70.85 -34.16 71.37 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 124.095 0.958 . . . . 0.0 110.279 178.88 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 37' ' ' SER . . . . . . . . . . . . . 9.6 t -79.69 -6.0 56.32 Favored 'General case' 0 N--CA 1.453 -0.309 0 C-N-CA 124.207 1.003 . . . . 0.0 111.906 179.388 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 68.03 20.55 72.9 Favored Glycine 0 CA--C 1.534 1.237 0 N-CA-C 110.642 -0.983 . . . . 0.0 110.642 -178.299 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 39' ' ' LEU . . . . . . . . . . . . . 55.4 mt -115.61 128.84 56.23 Favored 'General case' 0 CA--C 1.514 -0.413 0 N-CA-C 104.994 -2.224 . . . . 0.0 104.994 179.943 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 40' ' ' THR . . . . . . . . . . . . . 1.2 t -63.38 152.9 36.81 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 107.659 -1.237 . . . . 0.0 107.659 178.987 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 41' ' ' VAL . . . . . . . . . . . . . 40.2 t -47.64 -40.8 7.73 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.638 0 C-N-CA 124.454 1.102 . . . . 0.0 110.455 178.366 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 42' ' ' SER . . . . . . . . . . . . . 9.8 m -63.35 -36.62 84.3 Favored 'General case' 0 CA--C 1.546 0.791 0 O-C-N 119.827 -1.795 . . . . 0.0 111.667 179.809 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -74.82 -45.57 42.52 Favored 'General case' 0 C--O 1.223 -0.294 0 C-N-CA 125.612 1.565 . . . . 0.0 110.687 178.766 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 44' ' ' TYR . . . . . . . . . . . . . 4.1 t80 -55.89 -41.07 73.91 Favored 'General case' 0 CA--C 1.537 0.444 0 CA-C-N 119.158 0.89 . . . . 0.0 109.42 179.527 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 45' ' ' ILE . . . . . . . . . . . . . 13.2 mm -57.63 -64.31 0.55 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.37 0 CA-C-N 118.847 0.749 . . . . 0.0 109.763 178.897 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 46' ' ' ARG . . . . . . . . . . . . . 12.8 ptp180 -56.0 -46.53 78.71 Favored 'General case' 0 C--O 1.219 -0.508 0 CA-C-O 118.257 -0.878 . . . . 0.0 111.368 -179.15 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 47' ' ' ASN . . . . . . . . . . . . . 35.3 t30 -54.69 -54.43 41.92 Favored 'General case' 0 N--CA 1.452 -0.33 0 CA-C-N 118.989 0.813 . . . . 0.0 110.678 -179.557 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -64.13 -29.58 70.69 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 123.82 0.848 . . . . 0.0 112.35 -179.955 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 49' ' ' ALA . . . . . . . . . . . . . . . -78.75 -14.82 59.07 Favored 'General case' 0 CA--C 1.53 0.186 0 C-N-CA 124.372 1.069 . . . . 0.0 113.277 -179.557 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 11.8 mt -112.83 -35.4 5.48 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-N 119.241 0.928 . . . . 0.0 113.15 -179.264 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 51' ' ' ASN . . . . . . . . . . . . . 70.3 m-80 . . . . . 0 CA--C 1.5 -0.978 0 CA-C-O 116.339 -1.791 . . . . 0.0 112.279 -177.503 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 14.9 m . . . . . 0 N--CA 1.47 0.575 0 CA-C-O 120.586 0.231 . . . . 0.0 110.692 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 9.5 t0 -138.35 -172.34 3.26 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 127.033 2.133 . . . . 0.0 107.908 179.511 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 75.1 m -128.49 170.83 12.7 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-N 120.675 1.579 . . . . 0.0 110.99 179.469 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -74.18 -14.85 61.01 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 123.859 0.864 . . . . 0.0 112.125 179.517 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 12.5 m -130.67 121.27 50.03 Favored 'Isoleucine or valine' 0 C--O 1.234 0.284 0 N-CA-C 105.351 -2.092 . . . . 0.0 105.351 178.84 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 11.5 tpt180 -85.2 -55.25 4.13 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-O 118.644 -0.693 . . . . 0.0 110.464 -179.317 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 41.0 pttt 29.98 57.76 0.18 Allowed 'General case' 0 N--CA 1.466 0.374 0 C-N-CA 128.67 2.788 . . . . 0.0 111.681 -178.713 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 13.3 tptm -118.69 108.79 15.33 Favored 'General case' 0 CA--C 1.515 -0.384 0 N-CA-C 104.826 -2.287 . . . . 0.0 104.826 -179.601 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 5.8 p -120.61 173.7 7.03 Favored 'General case' 0 C--N 1.322 -0.597 0 C-N-CA 125.854 1.662 . . . . 0.0 110.99 -177.988 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 27.2 tt0 -76.14 132.18 39.85 Favored 'General case' 0 CA--C 1.535 0.387 0 N-CA-C 104.58 -2.378 . . . . 0.0 104.58 177.911 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 2.5 t -46.25 -41.84 4.55 Favored 'Isoleucine or valine' 0 C--O 1.237 0.437 0 C-N-CA 124.911 1.285 . . . . 0.0 113.357 -177.96 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 21.3 tpp180 -116.01 114.6 24.81 Favored 'General case' 0 C--O 1.235 0.315 0 N-CA-C 106.357 -1.72 . . . . 0.0 106.357 179.466 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 15.7 tt0 -81.16 86.18 6.23 Favored 'General case' 0 CA--C 1.527 0.09 0 N-CA-C 103.932 -2.618 . . . . 0.0 103.932 178.228 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 20.0 ptmt -60.61 -25.97 66.65 Favored 'General case' 0 C--O 1.225 -0.223 0 C-N-CA 123.611 0.764 . . . . 0.0 112.124 -179.101 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 5.8 t -90.0 159.63 16.78 Favored 'General case' 0 N--CA 1.444 -0.754 0 CA-C-O 122.323 1.059 . . . . 0.0 108.803 179.262 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 20.3 t -96.57 145.39 8.85 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.621 0 N-CA-C 104.603 -2.369 . . . . 0.0 104.603 178.062 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 8.0 p -143.38 107.45 1.23 Allowed 'Isoleucine or valine' 0 C--O 1.238 0.485 0 N-CA-C 104.909 -2.256 . . . . 0.0 104.909 178.295 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 10.0 ttt85 -141.94 162.14 36.21 Favored 'General case' 0 C--O 1.237 0.411 0 CA-C-O 121.423 0.63 . . . . 0.0 111.826 -179.251 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 42.0 m -92.12 103.43 15.92 Favored 'General case' 0 N--CA 1.445 -0.7 0 N-CA-C 105.144 -2.169 . . . . 0.0 105.144 179.503 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.457 HD12 ' HA ' ' A' ' 20' ' ' LEU . 18.6 tp -110.58 111.64 22.99 Favored 'General case' 0 C--N 1.323 -0.553 0 C-N-CA 123.931 0.893 . . . . 0.0 108.75 179.836 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 11.5 mmm-85 -94.51 150.96 19.73 Favored 'General case' 0 N--CA 1.451 -0.38 0 C-N-CA 124.637 1.175 . . . . 0.0 109.879 179.785 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 87.2 m-85 -128.82 179.09 5.91 Favored 'General case' 0 C--O 1.237 0.412 0 C-N-CA 125.853 1.661 . . . . 0.0 108.096 178.457 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' SER . . . . . 0.485 ' HB3' ' HD2' ' A' ' 24' ' ' PRO . 62.6 m -112.06 173.94 2.59 Favored Pre-proline 0 CA--C 1.543 0.687 0 CA-C-O 117.563 -1.208 . . . . 0.0 109.041 179.853 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 24' ' ' PRO . . . . . 0.485 ' HD2' ' HB3' ' A' ' 23' ' ' SER . 45.1 Cg_endo -68.51 -48.9 0.96 Allowed 'Trans proline' 0 C--N 1.35 0.617 0 CA-C-N 121.557 1.592 . . . . 0.0 113.478 -177.15 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 20.4 t -66.17 -37.2 79.21 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.432 0 N-CA-C 109.657 -0.498 . . . . 0.0 109.657 -179.499 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 49.8 mt-10 -64.62 -50.86 65.49 Favored 'General case' 0 C--N 1.341 0.212 0 N-CA-C 108.788 -0.819 . . . . 0.0 108.788 179.636 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 6.0 t70 -57.52 -45.34 85.11 Favored 'General case' 0 CA--C 1.513 -0.463 0 C-N-CA 124.972 1.309 . . . . 0.0 110.617 179.642 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -60.51 -46.19 91.06 Favored 'General case' 0 N--CA 1.45 -0.437 0 C-N-CA 123.296 0.638 . . . . 0.0 109.438 179.703 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 27.8 m -60.7 -57.08 14.2 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 123.179 0.592 . . . . 0.0 109.94 179.671 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 40.5 mt -58.03 -43.13 84.43 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.317 0 C-N-CA 124.927 1.291 . . . . 0.0 110.992 -178.815 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 43.5 ttt180 -62.29 -48.2 80.92 Favored 'General case' 0 CA--C 1.516 -0.363 0 C-N-CA 123.359 0.663 . . . . 0.0 110.499 -179.604 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -63.91 -46.11 86.27 Favored 'General case' 0 CA--C 1.518 -0.251 0 C-N-CA 120.659 -0.416 . . . . 0.0 110.09 -178.842 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 8.2 tptm -63.7 -44.63 93.07 Favored 'General case' 0 N--CA 1.455 -0.181 0 CA-C-O 119.615 -0.231 . . . . 0.0 110.993 -179.349 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -59.93 -51.64 68.82 Favored 'General case' 0 N--CA 1.454 -0.254 0 C-N-CA 124.041 0.936 . . . . 0.0 110.579 179.754 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 39.2 tt0 -64.65 -36.66 84.96 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-O 119.113 -0.47 . . . . 0.0 110.829 -179.053 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 27.5 t70 -67.69 -43.98 78.82 Favored 'General case' 0 CA--C 1.518 -0.267 0 C-N-CA 123.954 0.902 . . . . 0.0 109.802 179.147 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 31.2 t -73.23 -14.79 61.4 Favored 'General case' 0 CA--C 1.542 0.663 0 CA-C-O 122.105 0.955 . . . . 0.0 109.645 179.025 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 77.88 8.73 87.26 Favored Glycine 0 N--CA 1.443 -0.894 0 O-C-N 120.542 -1.349 . . . . 0.0 114.829 178.902 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 15.0 mt -114.41 118.36 33.62 Favored 'General case' 0 CA--C 1.515 -0.403 0 N-CA-C 103.742 -2.688 . . . . 0.0 103.742 179.252 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 12.7 t -48.13 158.75 0.23 Allowed 'General case' 0 C--N 1.329 -0.3 0 C-N-CA 124.811 1.244 . . . . 0.0 111.569 -179.292 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 69.7 t -46.06 -44.29 5.23 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.342 0 C-N-CA 125.038 1.335 . . . . 0.0 112.02 -178.885 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 11.8 p -62.72 -41.62 99.25 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-N 120.498 1.499 . . . . 0.0 111.848 -179.994 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -67.71 -49.98 59.87 Favored 'General case' 0 C--O 1.218 -0.569 0 N-CA-C 108.106 -1.072 . . . . 0.0 108.106 178.222 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 45.8 t80 -52.22 -51.38 58.59 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 123.963 0.905 . . . . 0.0 108.647 179.28 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.45 HG23 HG23 ' B' ' 45' ' ' ILE . 6.2 mm -55.61 -62.62 0.76 Allowed 'Isoleucine or valine' 0 C--O 1.225 -0.194 0 C-N-CA 125.704 1.602 . . . . 0.0 110.744 179.608 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 21.4 ptt180 -59.13 -45.7 90.24 Favored 'General case' 0 C--O 1.222 -0.343 0 CA-C-O 119.07 -0.491 . . . . 0.0 111.626 -178.162 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 21.7 t30 -58.25 -52.43 65.59 Favored 'General case' 0 N--CA 1.45 -0.464 0 C-N-CA 124.222 1.009 . . . . 0.0 111.099 -178.905 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -67.97 -25.62 65.53 Favored 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 124.333 1.053 . . . . 0.0 112.148 179.736 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -80.71 -41.97 22.72 Favored 'General case' 0 N--CA 1.454 -0.261 0 CA-C-N 118.428 0.558 . . . . 0.0 111.444 179.699 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 27.9 mt -73.2 -45.11 58.16 Favored 'General case' 0 CA--C 1.516 -0.355 0 C-N-CA 123.561 0.745 . . . . 0.0 111.809 -178.96 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 68.2 m-80 . . . . . 0 C--O 1.251 1.14 0 CA-C-O 116.961 -1.495 . . . . 0.0 111.136 -178.421 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 1' ' ' SER . . . . . . . . . . . . . 10.0 m . . . . . 0 N--CA 1.466 0.353 0 N-CA-C 108.906 -0.776 . . . . 0.0 108.906 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 2' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -121.44 159.63 25.83 Favored 'General case' 0 CA--C 1.514 -0.43 0 CA-C-O 122.187 0.994 . . . . 0.0 110.415 -179.434 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 3' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -92.17 174.31 7.37 Favored 'General case' 0 N--CA 1.443 -0.809 0 C-N-CA 126.834 2.053 . . . . 0.0 107.884 179.062 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 4' ' ' ALA . . . . . . . . . . . . . . . -70.9 -0.56 9.45 Favored 'General case' 0 CA--C 1.545 0.779 0 O-C-N 121.786 -0.571 . . . . 0.0 111.075 178.132 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 35.7 m -141.12 169.69 14.59 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.485 0 C-N-CA 128.014 2.526 . . . . 0.0 108.221 179.63 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 6' ' ' ARG . . . . . . . . . . . . . 11.0 tpt180 -133.39 -59.6 0.86 Allowed 'General case' 0 N--CA 1.462 0.142 0 C-N-CA 124.933 1.293 . . . . 0.0 111.178 -179.363 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 43.9 pttt 35.22 72.58 0.1 Allowed 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 126.975 2.11 . . . . 0.0 113.579 -179.856 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 20.0 tptm -117.81 93.2 4.06 Favored 'General case' 0 N--CA 1.465 0.294 0 O-C-N 121.452 -0.78 . . . . 0.0 111.324 -179.297 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 10.0 p -85.87 -178.1 6.51 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 127.14 2.176 . . . . 0.0 110.133 179.284 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 10' ' ' GLU . . . . . . . . . . . . . 10.1 tt0 -96.52 156.98 16.11 Favored 'General case' 0 CA--C 1.537 0.47 0 N-CA-C 107.613 -1.254 . . . . 0.0 107.613 178.037 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 11' ' ' VAL . . . . . . . . . . . . . 82.0 t -60.48 -67.69 0.29 Allowed 'Isoleucine or valine' 0 C--O 1.237 0.428 0 C-N-CA 124.729 1.211 . . . . 0.0 111.481 -179.078 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 12' ' ' ARG . . . . . . . . . . . . . 7.7 tpp85 -106.67 102.42 11.8 Favored 'General case' 0 CA--C 1.516 -0.35 0 N-CA-C 106.48 -1.674 . . . . 0.0 106.48 179.817 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 13' ' ' GLN . . . . . . . . . . . . . 5.1 tt0 -66.39 103.2 0.98 Allowed 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 106.927 -1.508 . . . . 0.0 106.927 179.3 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 8.2 ptmt -73.32 -23.65 60.28 Favored 'General case' 0 N--CA 1.467 0.383 0 C-N-CA 126.384 1.874 . . . . 0.0 114.925 -178.588 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 13.1 t -81.72 -169.06 2.15 Favored 'General case' 0 N--CA 1.443 -0.822 0 C-N-CA 126.257 1.823 . . . . 0.0 111.428 -178.425 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 2.6 t -143.73 91.22 0.41 Allowed 'Isoleucine or valine' 0 N--CA 1.441 -0.915 0 N-CA-C 103.757 -2.682 . . . . 0.0 103.757 178.378 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 8.1 p -92.27 118.6 38.15 Favored 'Isoleucine or valine' 0 C--O 1.239 0.528 0 N-CA-C 104.332 -2.47 . . . . 0.0 104.332 178.459 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 13.1 ttt85 -145.58 176.57 9.52 Favored 'General case' 0 C--O 1.233 0.229 0 O-C-N 121.432 -0.792 . . . . 0.0 109.732 -178.783 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 25.7 m -114.98 90.19 3.28 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 105.487 -2.042 . . . . 0.0 105.487 -179.546 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -95.06 106.12 18.09 Favored 'General case' 0 C--N 1.324 -0.533 0 C-N-CA 124.474 1.11 . . . . 0.0 108.176 -179.126 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 12.0 mtm180 -91.52 155.9 18.07 Favored 'General case' 0 C--O 1.238 0.467 0 CA-C-N 118.342 0.519 . . . . 0.0 111.357 178.892 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 22' ' ' PHE . . . . . . . . . . . . . 96.8 m-85 -136.44 143.97 44.17 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 107.801 -1.185 . . . . 0.0 107.801 179.796 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -75.21 168.17 30.07 Favored Pre-proline 0 CA--C 1.543 0.694 0 C-N-CA 123.555 0.742 . . . . 0.0 109.888 179.45 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 24' ' ' PRO . . . . . . . . . . . . . 34.2 Cg_endo -61.35 -40.83 45.91 Favored 'Trans proline' 0 C--N 1.348 0.541 0 C-N-CA 122.808 2.338 . . . . 0.0 113.283 -177.921 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 25' ' ' VAL . . . . . . . . . . . . . 38.5 t -72.15 -33.57 47.16 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.491 0 N-CA-C 109.271 -0.64 . . . . 0.0 109.271 179.562 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 68.6 mt-10 -65.94 -46.07 79.53 Favored 'General case' 0 C--N 1.343 0.316 0 N-CA-C 107.802 -1.184 . . . . 0.0 107.802 178.722 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 27' ' ' ASP . . . . . . . . . . . . . 4.0 t0 -58.9 -48.71 80.48 Favored 'General case' 0 CA--C 1.512 -0.494 0 C-N-CA 127.022 2.129 . . . . 0.0 110.075 179.216 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 28' ' ' GLU . . . . . . . . . . . . . 71.8 tt0 -56.38 -51.03 69.83 Favored 'General case' 0 N--CA 1.455 -0.204 0 CA-C-N 118.892 0.769 . . . . 0.0 109.874 179.53 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 60.8 m -60.94 -56.6 19.21 Favored 'General case' 0 N--CA 1.451 -0.422 0 C-N-CA 122.591 0.356 . . . . 0.0 110.934 -178.846 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 97.8 mt -57.26 -49.87 78.5 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.477 0 C-N-CA 123.001 0.52 . . . . 0.0 111.091 -178.57 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 53.2 ttt180 -59.84 -44.82 93.87 Favored 'General case' 0 CA--C 1.521 -0.171 0 CA-C-N 119.143 0.883 . . . . 0.0 111.284 -179.462 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.42 -45.48 87.39 Favored 'General case' 0 CA--C 1.51 -0.596 0 CA-C-O 118.765 -0.636 . . . . 0.0 110.693 -178.927 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 17.9 tptm -67.26 -46.96 72.13 Favored 'General case' 0 N--CA 1.453 -0.277 0 N-CA-C 109.61 -0.515 . . . . 0.0 109.61 -179.351 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 34' ' ' ALA . . . . . . . . . . . . . . . -56.86 -54.79 42.43 Favored 'General case' 0 N--CA 1.453 -0.292 0 C-N-CA 125.318 1.447 . . . . 0.0 112.693 -179.705 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 5.4 tt0 -70.2 -26.71 64.01 Favored 'General case' 0 C--O 1.233 0.235 0 N-CA-C 112.205 0.446 . . . . 0.0 112.205 -177.372 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 36' ' ' ASP . . . . . . . . . . . . . 15.0 t70 -75.04 -42.54 56.94 Favored 'General case' 0 C--N 1.331 -0.236 0 O-C-N 121.553 -0.717 . . . . 0.0 109.091 178.255 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 37' ' ' SER . . . . . . . . . . . . . 39.6 t -69.83 -23.81 63.36 Favored 'General case' 0 C--O 1.235 0.324 0 C-N-CA 126.017 1.727 . . . . 0.0 111.32 -179.812 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 81.09 23.18 59.65 Favored Glycine 0 CA--C 1.53 0.997 0 N-CA-C 110.355 -1.098 . . . . 0.0 110.355 -178.689 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 39' ' ' LEU . . . . . . . . . . . . . 57.8 mt -120.68 95.08 4.57 Favored 'General case' 0 N--CA 1.447 -0.62 1 N-CA-C 99.827 -4.138 . . . . 0.0 99.827 178.446 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 40' ' ' THR . . . . . . . . . . . . . 4.6 t -48.82 158.83 0.28 Allowed 'General case' 0 N--CA 1.457 -0.102 0 C-N-CA 122.783 0.433 . . . . 0.0 110.358 -178.952 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 41' ' ' VAL . . . . . . . . . . . . . 97.9 t -41.49 -47.9 0.83 Allowed 'Isoleucine or valine' 0 N--CA 1.447 -0.601 0 C-N-CA 124.221 1.008 . . . . 0.0 112.914 -176.828 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 42' ' ' SER . . . . . . . . . . . . . 2.5 p -65.43 -45.75 82.62 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 117.694 -1.603 . . . . 0.0 112.701 -179.403 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -61.02 -45.3 95.37 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 125.346 1.458 . . . . 0.0 110.389 179.225 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 44' ' ' TYR . . . . . . . . . . . . . 9.8 t80 -60.44 -46.29 90.57 Favored 'General case' 0 C--O 1.222 -0.342 0 C-N-CA 123.768 0.827 . . . . 0.0 109.861 179.456 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 45' ' ' ILE . . . . . 0.45 HG23 HG23 ' A' ' 45' ' ' ILE . 19.0 mm -57.67 -61.51 1.28 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.355 0 CA-C-N 119.656 1.116 . . . . 0.0 110.228 179.689 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 46' ' ' ARG . . . . . . . . . . . . . 21.7 ptt180 -53.65 -47.51 70.28 Favored 'General case' 0 CA--C 1.528 0.133 0 CA-C-O 119.373 -0.346 . . . . 0.0 111.641 -178.792 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 47' ' ' ASN . . . . . . . . . . . . . 41.9 t30 -64.33 -49.67 70.82 Favored 'General case' 0 C--O 1.234 0.286 0 N-CA-C 114.117 1.154 . . . . 0.0 114.117 -178.989 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -68.1 -21.31 64.97 Favored 'General case' 0 C--O 1.23 0.069 0 C-N-CA 124.19 0.996 . . . . 0.0 112.365 -179.344 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 49' ' ' ALA . . . . . . . . . . . . . . . -87.19 -40.3 14.7 Favored 'General case' 0 N--CA 1.451 -0.404 0 CA-C-N 118.587 0.63 . . . . 0.0 110.975 179.719 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 39.4 mt -68.29 -48.69 64.32 Favored 'General case' 0 C--O 1.233 0.208 0 O-C-N 121.612 -0.68 . . . . 0.0 112.834 -179.055 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 51' ' ' ASN . . . . . . . . . . . . . 44.2 m-80 . . . . . 0 C--O 1.247 0.922 0 CA-C-O 117.445 -1.264 . . . . 0.0 112.565 -177.026 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 1.1 t . . . . . 0 N--CA 1.472 0.64 0 N-CA-C 107.222 -1.399 . . . . 0.0 107.222 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 40.1 t0 -145.34 77.65 1.52 Allowed 'General case' 0 N--CA 1.466 0.325 0 CA-C-O 122.913 1.339 . . . . 0.0 108.415 -179.57 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 2.1 m -67.23 10.09 0.18 Allowed 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 127.743 2.417 . . . . 0.0 115.741 -178.854 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -66.83 102.83 1.0 Allowed 'General case' 0 CA--C 1.534 0.336 0 CA-C-N 120.649 1.568 . . . . 0.0 110.998 -179.42 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 41.2 t -77.32 86.17 0.89 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.39 0 C-N-CA 124.36 1.064 . . . . 0.0 109.138 179.576 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 5.1 ptp85 -78.17 -45.5 23.0 Favored 'General case' 0 C--N 1.332 -0.175 0 O-C-N 121.104 -0.998 . . . . 0.0 108.48 178.332 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 5.3 mptp? -82.94 100.46 10.42 Favored 'General case' 0 N--CA 1.455 -0.192 0 C-N-CA 125.37 1.468 . . . . 0.0 108.578 179.814 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 13.3 mptt -80.88 -66.47 0.88 Allowed 'General case' 0 N--CA 1.468 0.429 0 N-CA-C 105.74 -1.948 . . . . 0.0 105.74 178.71 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 54.3 p -155.67 162.32 40.61 Favored 'General case' 0 C--O 1.242 0.698 0 N-CA-C 105.22 -2.141 . . . . 0.0 105.22 177.599 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 19.4 pt-20 -123.72 3.49 8.88 Favored 'General case' 0 N--CA 1.467 0.388 0 N-CA-C 113.652 0.982 . . . . 0.0 113.652 -179.701 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 38.4 t -66.87 -51.6 53.53 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.405 0 C-N-CA 124.407 1.083 . . . . 0.0 111.329 -179.341 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 16.6 mtm180 -67.69 167.15 13.74 Favored 'General case' 0 N--CA 1.466 0.344 0 N-CA-C 112.88 0.696 . . . . 0.0 112.88 -178.788 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 57.6 mt-30 -86.24 139.74 30.76 Favored 'General case' 0 N--CA 1.448 -0.546 0 N-CA-C 105.552 -2.018 . . . . 0.0 105.552 177.589 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 21.6 ptmt -128.18 -31.05 2.37 Favored 'General case' 0 C--N 1.326 -0.426 0 C-N-CA 126.23 1.812 . . . . 0.0 107.71 178.455 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 3.2 t -72.92 -177.31 2.34 Favored 'General case' 0 N--CA 1.445 -0.687 0 N-CA-C 107.12 -1.437 . . . . 0.0 107.12 177.152 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 0.401 HG21 ' CG ' ' B' ' 27' ' ' ASP . 3.7 t -131.62 144.3 37.86 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 N-CA-C 106.038 -1.838 . . . . 0.0 106.038 178.435 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 9.4 p -135.61 103.53 4.01 Favored 'Isoleucine or valine' 0 C--O 1.238 0.487 0 N-CA-C 105.931 -1.877 . . . . 0.0 105.931 179.49 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 30.9 ttm180 -139.27 151.09 46.19 Favored 'General case' 0 CA--C 1.514 -0.438 0 CA-C-N 115.005 -0.998 . . . . 0.0 109.516 -179.706 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 19.4 m -103.05 144.6 31.08 Favored 'General case' 0 N--CA 1.449 -0.507 0 N-CA-C 107.344 -1.354 . . . . 0.0 107.344 -179.845 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 54.4 mt -133.32 142.33 48.4 Favored 'General case' 0 C--O 1.236 0.353 0 CA-C-O 121.902 0.858 . . . . 0.0 109.334 179.44 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 10.8 mmt85 -102.18 141.59 34.78 Favored 'General case' 0 N--CA 1.451 -0.389 0 C-N-CA 126.707 2.003 . . . . 0.0 106.809 178.898 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 95.0 m-85 -140.6 143.58 35.33 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 105.418 -2.067 . . . . 0.0 105.418 179.342 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 1.7 m -78.72 165.28 50.61 Favored Pre-proline 0 CA--C 1.539 0.526 0 N-CA-C 108.298 -1.001 . . . . 0.0 108.298 179.851 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -67.5 -21.14 46.86 Favored 'Trans proline' 0 CA--C 1.535 0.539 0 C-N-CA 122.018 1.812 . . . . 0.0 112.107 -179.642 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 16.0 t -82.89 -20.87 9.35 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.409 0 C-N-CA 125.07 1.348 . . . . 0.0 110.687 -179.686 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 93.6 mt-10 -92.61 -46.64 7.5 Favored 'General case' 0 CA--C 1.531 0.23 0 N-CA-C 107.047 -1.464 . . . . 0.0 107.047 178.782 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 2.9 t70 -55.69 -52.7 62.97 Favored 'General case' 0 CA--C 1.507 -0.693 0 C-N-CA 128.601 2.76 . . . . 0.0 112.817 179.792 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -60.99 -38.66 86.79 Favored 'General case' 0 N--CA 1.45 -0.447 0 C-N-CA 119.451 -0.9 . . . . 0.0 110.209 -178.508 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 89.5 m -64.96 -53.01 53.0 Favored 'General case' 0 N--CA 1.451 -0.376 0 CA-C-O 118.83 -0.605 . . . . 0.0 109.628 179.015 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 78.2 mt -56.57 -43.7 79.14 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.203 0 N-CA-C 109.06 -0.718 . . . . 0.0 109.06 -179.708 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 55.2 ttt180 -61.82 -50.6 71.66 Favored 'General case' 0 N--CA 1.455 -0.2 0 C-N-CA 123.734 0.814 . . . . 0.0 110.792 179.402 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 2.4 mptm? -61.86 -46.81 87.84 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-N 118.747 0.703 . . . . 0.0 110.257 -179.101 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 26.0 mmtp -63.74 -45.01 91.83 Favored 'General case' 0 C--O 1.227 -0.124 0 CA-C-N 118.655 0.661 . . . . 0.0 110.322 -179.799 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -60.57 -46.55 89.79 Favored 'General case' 0 C--O 1.237 0.413 0 C-N-CA 123.733 0.813 . . . . 0.0 110.424 179.753 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 27.7 tt0 -67.14 -39.65 86.62 Favored 'General case' 0 N--CA 1.454 -0.263 0 O-C-N 121.849 -0.532 . . . . 0.0 110.815 -179.564 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -67.58 -44.27 78.55 Favored 'General case' 0 N--CA 1.456 -0.168 0 O-C-N 121.747 -0.596 . . . . 0.0 110.347 -179.999 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 6.8 t -69.53 -17.29 63.57 Favored 'General case' 0 N--CA 1.449 -0.516 0 C-N-CA 124.553 1.141 . . . . 0.0 111.764 -178.602 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 75.43 26.42 65.76 Favored Glycine 0 CA--C 1.53 1.001 0 CA-C-N 118.853 0.751 . . . . 0.0 111.353 -179.969 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 88.6 mt -127.78 114.21 16.96 Favored 'General case' 0 N--CA 1.454 -0.233 0 C-N-CA 127.46 2.304 . . . . 0.0 105.517 179.902 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 9.4 t -52.22 154.9 2.16 Favored 'General case' 0 CA--C 1.536 0.421 0 CA-C-N 119.397 0.998 . . . . 0.0 109.664 179.747 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 53.6 t -46.78 -41.95 5.54 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.311 0 C-N-CA 125.407 1.483 . . . . 0.0 112.011 -179.052 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 7.1 p -63.86 -48.84 75.12 Favored 'General case' 0 CA--C 1.541 0.599 0 CA-C-N 119.599 1.09 . . . . 0.0 110.822 179.557 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -62.2 -45.56 92.84 Favored 'General case' 0 C--O 1.223 -0.293 0 C-N-CA 124.837 1.255 . . . . 0.0 109.509 178.621 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 71.6 t80 -54.92 -50.38 68.96 Favored 'General case' 0 N--CA 1.452 -0.351 0 C-N-CA 125.056 1.343 . . . . 0.0 108.802 179.308 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 8.3 mm -56.44 -63.59 0.6 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.316 0 C-N-CA 124.229 1.012 . . . . 0.0 110.505 179.406 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 25.8 ptt180 -55.53 -41.47 73.2 Favored 'General case' 0 N--CA 1.466 0.333 0 O-C-N 121.607 -0.683 . . . . 0.0 111.807 -178.657 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 22.2 t30 -60.81 -53.47 56.93 Favored 'General case' 0 N--CA 1.453 -0.321 0 C-N-CA 123.81 0.844 . . . . 0.0 110.944 179.803 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -63.82 -32.02 73.39 Favored 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 123.532 0.733 . . . . 0.0 112.375 -179.58 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -73.06 -28.73 62.48 Favored 'General case' 0 CA--C 1.531 0.222 0 N-CA-C 113.366 0.876 . . . . 0.0 113.366 -179.317 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 19.2 mt -92.23 -34.74 14.15 Favored 'General case' 0 C--O 1.236 0.381 0 O-C-N 121.912 -0.493 . . . . 0.0 110.758 -179.592 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 28.8 m-80 . . . . . 0 C--O 1.249 1.044 0 C-N-CA 124.438 1.095 . . . . 0.0 108.848 179.896 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 1' ' ' SER . . . . . . . . . . . . . 14.8 m . . . . . 0 N--CA 1.467 0.404 0 N-CA-C 108.165 -1.05 . . . . 0.0 108.165 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 2' ' ' ASP . . . . . . . . . . . . . 16.5 t0 -145.72 152.47 39.64 Favored 'General case' 0 C--O 1.234 0.24 0 N-CA-C 105.707 -1.96 . . . . 0.0 105.707 179.645 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 3' ' ' SER . . . . . . . . . . . . . 13.1 m -137.96 10.98 2.86 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 126.625 1.97 . . . . 0.0 110.386 -179.591 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 4' ' ' ALA . . . . . . . . . . . . . . . -70.54 72.94 0.52 Allowed 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 125.461 1.504 . . . . 0.0 112.895 -179.821 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 97.3 t -72.54 145.23 12.21 Favored 'Isoleucine or valine' 0 C--O 1.238 0.492 0 N-CA-C 105.055 -2.202 . . . . 0.0 105.055 177.544 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 6' ' ' ARG . . . . . . . . . . . . . 40.5 mtp85 -135.26 -54.26 0.79 Allowed 'General case' 0 N--CA 1.467 0.423 0 O-C-N 121.312 -0.868 . . . . 0.0 112.039 -179.26 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 32.1 mmtp -73.43 84.54 1.48 Allowed 'General case' 0 CA--C 1.529 0.163 0 C-N-CA 124.176 0.99 . . . . 0.0 111.609 -178.798 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 14.2 mptt -47.6 -63.88 0.93 Allowed 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 125.055 1.342 . . . . 0.0 109.79 179.087 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 72.4 p -153.09 -178.42 6.93 Favored 'General case' 0 N--CA 1.444 -0.753 0 C-N-CA 126.11 1.764 . . . . 0.0 107.727 -179.364 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 10' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -134.03 4.82 3.54 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 124.274 1.03 . . . . 0.0 112.259 178.363 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 11' ' ' VAL . . . . . . . . . . . . . 72.6 t -71.98 -55.89 11.94 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.239 0 N-CA-C 108.2 -1.037 . . . . 0.0 108.2 179.287 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 12' ' ' ARG . . . . . . . . . . . . . 9.8 mmm180 -54.2 129.16 34.0 Favored 'General case' 0 C--O 1.237 0.425 0 C-N-CA 126.469 1.908 . . . . 0.0 110.177 -178.857 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 13' ' ' GLN . . . . . . . . . . . . . 1.2 pt20 -75.85 96.09 3.63 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 105.294 -2.113 . . . . 0.0 105.294 178.01 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 17.9 ptmt -81.26 -29.74 34.3 Favored 'General case' 0 C--N 1.331 -0.202 0 C-N-CA 123.425 0.69 . . . . 0.0 111.986 -179.348 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 1.9 t -72.01 165.65 23.82 Favored 'General case' 0 N--CA 1.444 -0.747 0 N-CA-C 107.717 -1.216 . . . . 0.0 107.717 178.563 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 38.9 t -108.38 153.89 9.81 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.687 0 N-CA-C 105.884 -1.895 . . . . 0.0 105.884 178.332 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 9.8 p -150.24 103.48 0.33 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.555 0 N-CA-C 107.826 -1.176 . . . . 0.0 107.826 178.885 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 15.7 ttm180 -146.55 152.75 39.46 Favored 'General case' 0 C--N 1.328 -0.344 0 O-C-N 121.355 -0.84 . . . . 0.0 109.783 -179.932 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 7.1 m -96.72 140.08 31.83 Favored 'General case' 0 N--CA 1.448 -0.529 0 C-N-CA 125.446 1.498 . . . . 0.0 108.169 179.322 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 95.0 mt -123.06 165.73 16.31 Favored 'General case' 0 C--O 1.236 0.38 0 N-CA-C 106.965 -1.494 . . . . 0.0 106.965 178.213 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 1.9 mmt85 -125.22 143.92 50.71 Favored 'General case' 0 C--O 1.239 0.525 0 C-N-CA 126.565 1.946 . . . . 0.0 108.34 179.531 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 22' ' ' PHE . . . . . . . . . . . . . 97.4 m-85 -141.41 141.9 33.74 Favored 'General case' 0 CA--C 1.516 -0.347 0 N-CA-C 105.407 -2.071 . . . . 0.0 105.407 179.75 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 4.9 m -79.75 165.0 50.47 Favored Pre-proline 0 C--N 1.324 -0.531 0 CA-C-O 118.432 -0.794 . . . . 0.0 109.171 -179.482 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 24' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -67.27 -5.32 13.55 Favored 'Trans proline' 0 CA--C 1.537 0.645 0 C-N-CA 122.9 2.4 . . . . 0.0 113.165 179.811 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 25' ' ' VAL . . . . . . . . . . . . . 55.4 t -93.85 -61.75 1.99 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.487 0 N-CA-C 104.934 -2.247 . . . . 0.0 104.934 178.713 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 63.6 mt-10 -53.84 -48.12 70.28 Favored 'General case' 0 N--CA 1.455 -0.217 0 C-N-CA 126.186 1.795 . . . . 0.0 110.961 -179.528 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 27' ' ' ASP . . . . . 0.401 ' CG ' HG21 ' A' ' 16' ' ' VAL . 15.5 t70 -61.25 -50.68 72.08 Favored 'General case' 0 CA--C 1.511 -0.526 0 C-N-CA 124.81 1.244 . . . . 0.0 112.048 -179.841 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 28' ' ' GLU . . . . . . . . . . . . . 5.4 tp10 -60.26 -43.57 96.04 Favored 'General case' 0 N--CA 1.449 -0.478 0 N-CA-C 108.645 -0.872 . . . . 0.0 108.645 -179.318 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 53.4 m -59.37 -54.36 47.59 Favored 'General case' 0 N--CA 1.452 -0.339 0 N-CA-C 108.731 -0.84 . . . . 0.0 108.731 178.902 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 71.3 mt -58.53 -43.96 88.15 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.317 0 C-N-CA 123.194 0.597 . . . . 0.0 110.191 -179.524 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 31.5 ttt180 -56.3 -49.44 74.29 Favored 'General case' 0 C--N 1.333 -0.147 0 C-N-CA 123.929 0.891 . . . . 0.0 109.624 179.711 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 1.4 mptm? -67.4 -43.07 82.21 Favored 'General case' 0 C--O 1.223 -0.309 0 CA-C-O 117.758 -1.115 . . . . 0.0 110.757 -179.572 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 29.3 mmtp -63.11 -44.14 96.49 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-N 119.842 1.201 . . . . 0.0 110.665 -179.559 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 34' ' ' ALA . . . . . . . . . . . . . . . -59.32 -56.6 20.02 Favored 'General case' 0 N--CA 1.451 -0.423 0 C-N-CA 124.8 1.24 . . . . 0.0 109.158 179.63 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -61.77 -37.94 86.18 Favored 'General case' 0 C--O 1.236 0.364 0 C-N-CA 123.389 0.676 . . . . 0.0 112.024 -178.688 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 36' ' ' ASP . . . . . . . . . . . . . 9.3 t70 -64.54 -40.7 96.08 Favored 'General case' 0 C--N 1.332 -0.153 0 C-N-CA 125.337 1.455 . . . . 0.0 108.655 178.785 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 37' ' ' SER . . . . . . . . . . . . . 6.2 t -77.78 -8.36 57.9 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 123.738 0.815 . . . . 0.0 110.453 179.013 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 69.45 24.17 76.22 Favored Glycine 0 CA--C 1.531 1.041 0 O-C-N 121.053 -1.029 . . . . 0.0 110.733 -178.991 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 39' ' ' LEU . . . . . . . . . . . . . 71.7 mt -115.99 128.07 55.44 Favored 'General case' 0 N--CA 1.447 -0.595 0 C-N-CA 126.313 1.845 . . . . 0.0 107.399 -179.239 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 40' ' ' THR . . . . . . . . . . . . . 3.5 t -57.31 145.28 32.69 Favored 'General case' 0 CA--C 1.538 0.51 0 N-CA-C 106.717 -1.586 . . . . 0.0 106.717 177.747 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 41' ' ' VAL . . . . . . . . . . . . . 94.1 t -49.8 -41.09 16.63 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.28 0 O-C-N 120.772 -1.205 . . . . 0.0 112.106 -178.735 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 42' ' ' SER . . . . . . . . . . . . . 11.3 m -61.64 -40.75 96.0 Favored 'General case' 0 CA--C 1.541 0.61 0 CA-C-N 119.768 1.167 . . . . 0.0 111.373 -179.648 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -68.59 -44.09 75.08 Favored 'General case' 0 C--O 1.22 -0.477 0 C-N-CA 124.389 1.076 . . . . 0.0 108.097 178.13 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 44' ' ' TYR . . . . . . . . . . . . . 70.6 t80 -55.22 -51.99 64.81 Favored 'General case' 0 N--CA 1.454 -0.254 0 N-CA-C 108.726 -0.842 . . . . 0.0 108.726 179.393 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 45' ' ' ILE . . . . . . . . . . . . . 19.3 mm -53.24 -64.65 0.38 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.23 0 C-N-CA 124.328 1.051 . . . . 0.0 111.47 179.545 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 46' ' ' ARG . . . . . . . . . . . . . 27.1 ptt180 -58.11 -42.06 84.92 Favored 'General case' 0 C--O 1.223 -0.331 0 CA-C-O 118.745 -0.645 . . . . 0.0 111.716 -177.978 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 47' ' ' ASN . . . . . . . . . . . . . 43.8 t30 -60.92 -54.84 40.16 Favored 'General case' 0 N--CA 1.45 -0.474 0 CA-C-O 118.655 -0.688 . . . . 0.0 110.216 -179.72 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -58.78 -31.31 68.27 Favored 'General case' 0 CA--C 1.53 0.201 0 C-N-CA 124.03 0.932 . . . . 0.0 111.56 -179.783 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 49' ' ' ALA . . . . . . . . . . . . . . . -74.86 -20.89 59.55 Favored 'General case' 0 N--CA 1.454 -0.273 0 N-CA-C 113.267 0.84 . . . . 0.0 113.267 -179.708 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 11.8 mt -107.91 -29.02 9.27 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 119.417 1.008 . . . . 0.0 111.592 -179.41 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 51' ' ' ASN . . . . . . . . . . . . . 73.0 m-20 . . . . . 0 C--O 1.245 0.855 0 C-N-CA 126.41 1.884 . . . . 0.0 109.817 -178.99 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 15.2 t . . . . . 0 N--CA 1.474 0.747 0 N-CA-C 107.27 -1.382 . . . . 0.0 107.27 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 12.3 p-10 -99.56 -21.14 16.03 Favored 'General case' 0 C--N 1.327 -0.382 0 C-N-CA 127.168 2.187 . . . . 0.0 112.514 -179.339 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 29.7 t -140.71 146.78 38.23 Favored 'General case' 0 N--CA 1.449 -0.506 0 N-CA-C 106.373 -1.714 . . . . 0.0 106.373 -179.444 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -63.21 150.94 41.79 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-O 121.285 0.564 . . . . 0.0 109.517 179.603 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 13.5 p -69.86 -25.75 28.83 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.601 0 O-C-N 122.094 -0.379 . . . . 0.0 110.58 179.705 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 70.5 mtp180 -106.25 133.74 50.48 Favored 'General case' 0 C--N 1.338 0.097 0 N-CA-C 106.772 -1.566 . . . . 0.0 106.772 179.122 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 21.2 pttp -149.1 -51.6 0.16 Allowed 'General case' 0 C--N 1.332 -0.191 0 C-N-CA 124.946 1.298 . . . . 0.0 109.012 179.416 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 15.5 mmtp -71.68 101.25 2.5 Favored 'General case' 0 C--O 1.234 0.253 0 N-CA-C 106.864 -1.532 . . . . 0.0 106.864 178.639 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 52.1 m -166.34 143.02 4.97 Favored 'General case' 0 C--O 1.235 0.341 0 C-N-CA 124.86 1.264 . . . . 0.0 109.329 178.58 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER 178.19 157.23 0.43 Allowed 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 128.915 2.886 . . . . 0.0 107.906 178.643 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 7.8 p -128.52 -22.09 1.58 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.422 0 C-N-CA 124.892 1.277 . . . . 0.0 111.775 -179.792 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 32.7 mtt85 -148.3 126.77 12.36 Favored 'General case' 0 N--CA 1.45 -0.437 0 N-CA-C 105.715 -1.957 . . . . 0.0 105.715 179.779 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 66.1 mt-30 -59.54 98.46 0.05 OUTLIER 'General case' 0 C--N 1.331 -0.226 0 C-N-CA 124.515 1.126 . . . . 0.0 109.013 -179.715 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 19.4 ptmt -77.76 -34.93 52.22 Favored 'General case' 0 N--CA 1.464 0.259 0 C-N-CA 123.001 0.52 . . . . 0.0 110.696 179.714 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 4.3 t -64.17 164.38 11.0 Favored 'General case' 0 N--CA 1.445 -0.691 0 C-N-CA 123.785 0.834 . . . . 0.0 109.409 179.227 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 0.424 HG21 ' HB2' ' B' ' 27' ' ' ASP . 1.4 t -125.62 102.76 10.8 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.457 0 C-N-CA 123.562 0.745 . . . . 0.0 110.187 -177.9 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 3.1 p -101.25 127.51 54.45 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.412 0 C-N-CA 124.133 0.973 . . . . 0.0 110.872 -178.035 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 14.8 ttm180 -154.66 160.92 41.71 Favored 'General case' 0 C--O 1.237 0.399 0 N-CA-C 108.771 -0.826 . . . . 0.0 108.771 178.045 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 7.1 m -90.76 91.61 8.45 Favored 'General case' 0 C--O 1.237 0.401 0 N-CA-C 107.473 -1.306 . . . . 0.0 107.473 179.565 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -97.84 100.78 12.15 Favored 'General case' 0 C--O 1.236 0.393 0 N-CA-C 107.568 -1.271 . . . . 0.0 107.568 179.147 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 32.9 mtt180 -87.57 159.03 18.75 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 108.992 -0.744 . . . . 0.0 108.992 179.585 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 86.0 m-85 -136.58 152.02 50.01 Favored 'General case' 0 CA--C 1.511 -0.535 0 N-CA-C 108.151 -1.055 . . . . 0.0 108.151 -179.765 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -82.88 171.83 10.84 Favored Pre-proline 0 CA--C 1.539 0.525 0 N-CA-C 107.48 -1.304 . . . . 0.0 107.48 179.664 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -67.24 -37.26 18.68 Favored 'Trans proline' 0 N--CA 1.457 -0.66 0 C-N-CA 121.483 1.455 . . . . 0.0 112.712 -178.473 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 92.3 t -66.58 -53.06 39.2 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.324 0 N-CA-C 107.825 -1.176 . . . . 0.0 107.825 179.508 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 -57.84 -47.24 83.25 Favored 'General case' 0 N--CA 1.455 -0.182 0 C-N-CA 122.941 0.496 . . . . 0.0 110.443 179.576 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 21.7 t70 -59.54 -52.27 66.29 Favored 'General case' 0 CA--C 1.507 -0.676 0 C-N-CA 123.147 0.579 . . . . 0.0 111.257 -179.979 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -56.1 -38.54 70.89 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 118.351 0.523 . . . . 0.0 110.594 -179.456 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 25.9 m -67.05 -56.48 9.9 Favored 'General case' 0 N--CA 1.449 -0.495 0 C-N-CA 123.359 0.664 . . . . 0.0 109.874 179.527 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 88.2 mt -60.16 -38.89 78.85 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.252 0 C-N-CA 123.834 0.854 . . . . 0.0 109.758 -179.394 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 64.4 ttt180 -61.86 -51.72 67.05 Favored 'General case' 0 C--O 1.223 -0.293 0 C-N-CA 124.857 1.263 . . . . 0.0 108.341 179.217 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 2.6 mptp? -59.42 -48.97 79.61 Favored 'General case' 0 CA--C 1.515 -0.381 0 C-N-CA 123.305 0.642 . . . . 0.0 109.529 179.78 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 64.4 mmtt -60.88 -45.72 93.47 Favored 'General case' 0 CA--C 1.509 -0.626 0 CA-C-O 118.565 -0.731 . . . . 0.0 111.871 -178.943 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -63.41 -53.71 48.12 Favored 'General case' 0 N--CA 1.446 -0.665 0 O-C-N 123.595 0.559 . . . . 0.0 110.161 -179.256 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -61.13 -36.88 80.91 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 123.378 0.671 . . . . 0.0 111.824 -177.866 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -73.41 -33.77 65.13 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 125.331 1.452 . . . . 0.0 109.696 178.752 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 30.0 t -72.71 -13.69 61.4 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 125.079 1.352 . . . . 0.0 108.09 177.55 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 82.95 -9.88 59.06 Favored Glycine 0 C--N 1.338 0.694 0 C-N-CA 125.639 1.59 . . . . 0.0 111.784 -179.01 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 82.6 mt -86.3 173.25 9.86 Favored 'General case' 0 N--CA 1.439 -0.98 0 C-N-CA 126.0 1.72 . . . . 0.0 107.222 179.745 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -96.51 157.09 16.06 Favored 'General case' 0 C--N 1.317 -0.844 0 N-CA-C 104.548 -2.389 . . . . 0.0 104.548 177.362 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 84.3 t -51.01 -40.9 21.51 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.382 0 C-N-CA 123.635 0.774 . . . . 0.0 109.503 178.731 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 10.5 p -60.99 -45.05 96.35 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-N 120.428 1.467 . . . . 0.0 112.012 -179.652 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -66.68 -48.39 69.47 Favored 'General case' 0 C--O 1.225 -0.185 0 C-N-CA 123.973 0.909 . . . . 0.0 109.523 179.104 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 87.9 t80 -56.52 -47.13 80.01 Favored 'General case' 0 CA--C 1.538 0.503 0 N-CA-C 109.584 -0.524 . . . . 0.0 109.584 179.819 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 5.9 mm -54.58 -64.45 0.44 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.357 0 C-N-CA 124.896 1.278 . . . . 0.0 110.592 179.477 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 13.1 ptm180 -56.08 -45.06 79.49 Favored 'General case' 0 C--O 1.219 -0.5 0 CA-C-O 118.97 -0.538 . . . . 0.0 110.889 -178.744 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 43.0 t30 -59.28 -54.91 41.45 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-N 118.405 0.548 . . . . 0.0 111.901 -179.299 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -61.81 -29.93 70.48 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 123.813 0.845 . . . . 0.0 111.596 -179.603 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -75.0 -23.06 58.18 Favored 'General case' 0 C--O 1.223 -0.291 0 N-CA-C 113.615 0.969 . . . . 0.0 113.615 179.84 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 6.9 mt -99.93 -39.1 8.33 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 119.62 1.1 . . . . 0.0 112.174 -178.643 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 22.0 m-80 . . . . . 0 C--O 1.254 1.325 0 CA-C-O 116.329 -1.796 . . . . 0.0 113.187 -178.817 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 1' ' ' SER . . . . . . . . . . . . . 1.2 t . . . . . 0 N--CA 1.47 0.542 0 N-CA-C 105.311 -2.107 . . . . 0.0 105.311 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 2' ' ' ASP . . . . . . . . . . . . . 5.6 p-10 -146.33 -45.79 0.19 Allowed 'General case' 0 C--N 1.327 -0.408 0 O-C-N 124.313 1.008 . . . . 0.0 109.808 -178.446 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 3' ' ' SER . . . . . . . . . . . . . 4.4 t -136.51 153.5 51.0 Favored 'General case' 0 N--CA 1.448 -0.525 0 N-CA-C 108.698 -0.853 . . . . 0.0 108.698 -179.583 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 4' ' ' ALA . . . . . . . . . . . . . . . -61.64 141.84 57.55 Favored 'General case' 0 C--O 1.233 0.211 0 C-N-CA 122.761 0.424 . . . . 0.0 110.066 179.847 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 11.1 p -62.14 -15.4 14.1 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.588 0 C-N-CA 124.621 1.168 . . . . 0.0 113.288 -179.678 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 6' ' ' ARG . . . . . . . . . . . . . 46.9 mtm180 -114.52 129.49 56.67 Favored 'General case' 0 CA--C 1.519 -0.214 0 O-C-N 120.734 -1.229 . . . . 0.0 108.131 179.171 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 20.7 pttp -137.16 -45.76 0.57 Allowed 'General case' 0 CA--C 1.519 -0.237 0 CA-C-O 118.489 -0.767 . . . . 0.0 111.617 178.07 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 9.3 mtmp? -72.47 92.32 1.46 Allowed 'General case' 0 C--O 1.232 0.175 0 CA-C-N 119.292 0.951 . . . . 0.0 109.862 179.831 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 44.3 m -140.17 97.64 3.28 Favored 'General case' 0 C--N 1.331 -0.238 0 C-N-CA 125.205 1.402 . . . . 0.0 107.341 179.254 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 10' ' ' GLU . . . . . . . . . . . . . 28.1 tt0 -135.49 124.02 23.55 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 105.465 -2.05 . . . . 0.0 105.465 179.286 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 11' ' ' VAL . . . . . . . . . . . . . 88.7 t -114.52 -29.28 2.23 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.481 0 C-N-CA 124.542 1.137 . . . . 0.0 109.665 -179.588 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -146.13 135.08 22.55 Favored 'General case' 0 C--O 1.238 0.486 0 N-CA-C 105.006 -2.22 . . . . 0.0 105.006 178.803 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 13' ' ' GLN . . . . . . . . . . . . . 68.7 mt-30 -76.74 83.49 3.36 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 122.62 1.2 . . . . 0.0 108.735 -179.251 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 46.4 pttt -70.43 -21.16 62.85 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 115.399 -0.818 . . . . 0.0 111.772 179.388 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 4.6 t -78.12 173.15 12.54 Favored 'General case' 0 N--CA 1.449 -0.505 0 N-CA-C 108.202 -1.036 . . . . 0.0 108.202 178.472 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 24.7 t -116.28 148.18 19.17 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.504 0 N-CA-C 106.524 -1.658 . . . . 0.0 106.524 179.146 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 10.7 p -141.25 106.26 1.7 Allowed 'Isoleucine or valine' 0 N--CA 1.447 -0.614 0 N-CA-C 107.299 -1.371 . . . . 0.0 107.299 177.644 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 33.0 ttm180 -136.51 159.74 40.88 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.32 -0.855 . . . . 0.0 109.228 179.911 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 11.6 m -97.38 87.62 4.19 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 107.42 -1.326 . . . . 0.0 107.42 -179.78 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -81.82 105.49 12.99 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 108.812 -0.81 . . . . 0.0 108.812 -179.806 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 10.1 mtm180 -93.7 142.28 27.54 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 126.56 1.944 . . . . 0.0 110.918 -179.885 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 22' ' ' PHE . . . . . . . . . . . . . 78.0 m-85 -129.56 170.52 13.65 Favored 'General case' 0 N--CA 1.482 1.128 0 C-N-CA 125.192 1.397 . . . . 0.0 111.365 -179.15 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 2.0 m -99.09 166.03 13.78 Favored Pre-proline 0 CA--C 1.538 0.483 0 N-CA-C 108.04 -1.096 . . . . 0.0 108.04 178.809 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 24' ' ' PRO . . . . . . . . . . . . . 70.6 Cg_endo -69.16 -28.43 28.15 Favored 'Trans proline' 0 N--CA 1.458 -0.561 0 C-N-CA 121.442 1.428 . . . . 0.0 112.398 -179.72 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 25' ' ' VAL . . . . . . . . . . . . . 96.1 t -67.51 -56.75 12.12 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.31 0 N-CA-C 106.751 -1.574 . . . . 0.0 106.751 179.249 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 1.4 mp0 -56.44 -44.05 80.09 Favored 'General case' 0 CA--C 1.528 0.114 0 C-N-CA 124.92 1.288 . . . . 0.0 111.432 179.53 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 27' ' ' ASP . . . . . 0.424 ' HB2' HG21 ' A' ' 16' ' ' VAL . 30.1 t70 -62.78 -37.53 87.05 Favored 'General case' 0 CA--C 1.517 -0.3 0 N-CA-C 113.131 0.789 . . . . 0.0 113.131 -179.628 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 28' ' ' GLU . . . . . . . . . . . . . 32.3 tt0 -61.62 -50.82 71.0 Favored 'General case' 0 N--CA 1.45 -0.439 0 N-CA-C 107.141 -1.429 . . . . 0.0 107.141 178.963 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 30.3 m -58.83 -59.22 5.78 Favored 'General case' 0 N--CA 1.451 -0.395 0 C-N-CA 124.489 1.116 . . . . 0.0 111.279 -179.473 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 74.9 mt -56.67 -46.12 82.83 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.22 0 C-N-CA 124.45 1.1 . . . . 0.0 110.24 -178.78 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 56.4 ttt180 -62.22 -45.45 93.3 Favored 'General case' 0 CA--C 1.518 -0.279 0 CA-C-N 119.288 0.949 . . . . 0.0 111.255 -179.499 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 4.9 mptp? -60.05 -51.37 69.91 Favored 'General case' 0 CA--C 1.515 -0.397 0 N-CA-C 109.802 -0.444 . . . . 0.0 109.802 -179.059 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 37.2 mmtt -60.27 -52.99 62.92 Favored 'General case' 0 N--CA 1.449 -0.512 0 O-C-N 124.431 1.082 . . . . 0.0 111.022 -179.035 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 34' ' ' ALA . . . . . . . . . . . . . . . -55.94 -54.05 49.42 Favored 'General case' 0 N--CA 1.45 -0.467 0 C-N-CA 123.674 0.79 . . . . 0.0 111.318 -178.818 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 24.6 tt0 -63.16 -42.77 99.47 Favored 'General case' 0 N--CA 1.451 -0.406 0 N-CA-C 112.588 0.588 . . . . 0.0 112.588 -178.094 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 36' ' ' ASP . . . . . . . . . . . . . 26.9 t70 -65.64 -36.9 85.02 Favored 'General case' 0 C--O 1.232 0.143 0 C-N-CA 123.586 0.754 . . . . 0.0 110.502 -179.888 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 37' ' ' SER . . . . . . . . . . . . . 12.4 t -78.83 -7.25 57.7 Favored 'General case' 0 N--CA 1.446 -0.629 0 C-N-CA 123.995 0.918 . . . . 0.0 110.819 179.261 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 70.62 10.34 66.92 Favored Glycine 0 CA--C 1.536 1.346 0 CA-C-N 119.732 1.151 . . . . 0.0 113.28 -179.616 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 39' ' ' LEU . . . . . . . . . . . . . 15.2 mt -108.92 107.56 17.99 Favored 'General case' 0 N--CA 1.451 -0.382 0 N-CA-C 103.961 -2.607 . . . . 0.0 103.961 179.475 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 40' ' ' THR . . . . . . . . . . . . . 13.5 t -46.74 151.66 0.57 Allowed 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 123.808 0.843 . . . . 0.0 109.969 179.582 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 41' ' ' VAL . . . . . . . . . . . . . 58.8 t -43.62 -43.14 1.64 Allowed 'Isoleucine or valine' 0 CA--C 1.527 0.07 0 C-N-CA 125.441 1.496 . . . . 0.0 111.902 -178.109 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 42' ' ' SER . . . . . . . . . . . . . 5.4 p -66.55 -43.64 84.52 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-N 119.588 1.085 . . . . 0.0 112.747 179.458 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.72 -40.76 97.55 Favored 'General case' 0 C--O 1.232 0.137 0 N-CA-C 109.175 -0.676 . . . . 0.0 109.175 178.583 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 44' ' ' TYR . . . . . . . . . . . . . 64.3 t80 -60.6 -53.31 59.04 Favored 'General case' 0 N--CA 1.442 -0.841 0 N-CA-C 107.975 -1.12 . . . . 0.0 107.975 179.146 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 45' ' ' ILE . . . . . . . . . . . . . 19.7 mm -55.04 -54.46 23.85 Favored 'Isoleucine or valine' 0 C--N 1.341 0.231 0 C-N-CA 123.387 0.675 . . . . 0.0 109.285 179.521 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 46' ' ' ARG . . . . . . . . . . . . . 1.1 mtp180 -47.29 -64.59 0.74 Allowed 'General case' 0 C--O 1.22 -0.465 0 C-N-CA 124.138 0.975 . . . . 0.0 109.902 179.43 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 47' ' ' ASN . . . . . . . . . . . . . 27.4 t30 -54.19 -51.15 65.3 Favored 'General case' 0 C--N 1.325 -0.499 0 C-N-CA 126.583 1.953 . . . . 0.0 113.763 -177.944 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -60.39 -29.28 68.84 Favored 'General case' 0 N--CA 1.453 -0.324 0 C-N-CA 122.997 0.519 . . . . 0.0 112.362 -179.062 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 49' ' ' ALA . . . . . . . . . . . . . . . -86.41 -12.42 49.21 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 113.675 0.991 . . . . 0.0 113.675 -179.306 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 11.2 mt -104.86 -29.09 10.73 Favored 'General case' 0 CA--C 1.516 -0.353 0 O-C-N 121.213 -0.929 . . . . 0.0 111.154 -178.932 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 51' ' ' ASN . . . . . . . . . . . . . 74.4 m-80 . . . . . 0 C--O 1.249 1.04 0 C-N-CA 125.337 1.455 . . . . 0.0 111.298 -179.057 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 8.7 t . . . . . 0 N--CA 1.482 1.142 0 CA-C-O 122.978 1.371 . . . . 0.0 108.273 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -72.92 -43.69 62.1 Favored 'General case' 0 C--N 1.32 -0.717 1 C-N-CA 134.35 5.06 . . . . 0.0 110.324 -177.142 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 59.0 m -105.98 124.31 49.37 Favored 'General case' 0 N--CA 1.447 -0.586 0 C-N-CA 125.171 1.388 . . . . 0.0 107.291 179.178 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -151.37 156.27 40.38 Favored 'General case' 0 C--O 1.242 0.663 0 C-N-CA 125.061 1.345 . . . . 0.0 108.084 179.728 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 27.0 m -60.67 152.69 5.37 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.276 0 C-N-CA 124.2 1.0 . . . . 0.0 109.357 179.438 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 18.7 ptp180 -160.26 152.73 20.85 Favored 'General case' 0 CA--C 1.521 -0.158 0 O-C-N 121.512 -0.742 . . . . 0.0 109.744 -179.544 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 41.1 mttm -71.24 152.54 43.21 Favored 'General case' 0 C--O 1.235 0.332 0 N-CA-C 106.228 -1.767 . . . . 0.0 106.228 178.144 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -133.72 -77.52 0.47 Allowed 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 105.814 -1.921 . . . . 0.0 105.814 179.122 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 71.5 m -142.95 -167.7 2.6 Favored 'General case' 0 C--N 1.326 -0.417 0 C-N-CA 126.366 1.867 . . . . 0.0 106.347 178.893 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -153.61 -159.74 1.02 Allowed 'General case' 0 C--O 1.241 0.608 0 O-C-N 121.002 -1.061 . . . . 0.0 108.867 -179.864 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 1.4 m -55.69 113.63 0.53 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.249 0 C-N-CA 124.783 1.233 . . . . 0.0 108.701 178.994 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 6.2 ptp85 -65.32 -27.26 68.48 Favored 'General case' 0 N--CA 1.469 0.519 0 O-C-N 121.398 -0.814 . . . . 0.0 110.115 179.033 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 52.2 tt0 -124.61 99.09 6.01 Favored 'General case' 0 N--CA 1.443 -0.776 0 C-N-CA 128.565 2.746 . . . . 0.0 104.629 -179.812 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' LYS . . . . . 0.465 ' HE3' ' HG3' ' B' ' 24' ' ' PRO . 21.1 ptmt -72.25 -36.84 69.17 Favored 'General case' 0 N--CA 1.464 0.227 0 C-N-CA 124.64 1.176 . . . . 0.0 109.872 179.576 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 3.1 t -72.21 162.56 29.3 Favored 'General case' 0 N--CA 1.451 -0.391 0 N-CA-C 107.691 -1.226 . . . . 0.0 107.691 178.507 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 2.5 t -107.29 145.87 14.18 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.764 0 N-CA-C 106.552 -1.648 . . . . 0.0 106.552 179.142 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 14.5 p -140.69 110.26 3.24 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.765 0 N-CA-C 105.209 -2.145 . . . . 0.0 105.209 178.298 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 21.6 ttt85 -144.72 -175.86 4.83 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 109.348 -0.612 . . . . 0.0 109.348 -178.945 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 13.4 m -119.35 112.43 19.42 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-N 118.82 0.737 . . . . 0.0 110.519 -179.107 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.451 HD21 ' HA ' ' B' ' 42' ' ' SER . 0.0 OUTLIER -105.56 100.74 10.3 Favored 'General case' 0 C--O 1.236 0.344 0 C-N-CA 125.788 1.635 . . . . 0.0 107.64 179.788 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 6.1 mtt180 -84.97 157.46 20.79 Favored 'General case' 0 C--O 1.234 0.239 0 N-CA-C 108.437 -0.949 . . . . 0.0 108.437 177.937 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 92.7 m-85 -140.24 152.54 46.03 Favored 'General case' 0 C--O 1.236 0.359 0 N-CA-C 107.38 -1.341 . . . . 0.0 107.38 179.629 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 1.5 m -83.06 171.59 11.34 Favored Pre-proline 0 CA--C 1.547 0.832 0 CA-C-O 117.772 -1.109 . . . . 0.0 108.233 179.602 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_endo -63.75 -48.44 5.48 Favored 'Trans proline' 0 C--N 1.347 0.497 0 C-N-CA 122.025 1.817 . . . . 0.0 114.713 -177.417 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 93.9 t -64.63 -37.96 81.42 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.337 0 C-N-CA 124.787 1.235 . . . . 0.0 110.375 -179.603 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -64.33 -53.48 48.14 Favored 'General case' 0 N--CA 1.454 -0.264 0 C-N-CA 125.526 1.53 . . . . 0.0 108.043 -179.576 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 3.5 t70 -60.24 -42.91 96.27 Favored 'General case' 0 C--N 1.331 -0.204 0 C-N-CA 127.479 2.312 . . . . 0.0 111.425 179.583 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 88.7 tt0 -63.88 -49.39 72.89 Favored 'General case' 0 N--CA 1.45 -0.434 0 N-CA-C 108.018 -1.105 . . . . 0.0 108.018 179.135 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 91.2 m -58.54 -49.78 76.17 Favored 'General case' 0 CA--C 1.533 0.325 0 N-CA-C 109.169 -0.678 . . . . 0.0 109.169 179.274 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 0.403 HD13 HD11 ' A' ' 45' ' ' ILE . 34.0 mt -58.07 -46.34 88.15 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.303 0 C-N-CA 123.307 0.643 . . . . 0.0 109.38 179.54 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 29.1 ttt180 -60.36 -51.19 70.55 Favored 'General case' 0 CA--C 1.518 -0.284 0 CA-C-N 118.784 0.72 . . . . 0.0 110.839 -179.626 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 1.7 mptm? -61.85 -44.9 95.9 Favored 'General case' 0 CA--C 1.52 -0.21 0 CA-C-O 118.547 -0.74 . . . . 0.0 109.691 -179.092 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 38.4 tptt -64.57 -38.97 92.83 Favored 'General case' 0 C--O 1.224 -0.255 0 CA-C-N 118.905 0.775 . . . . 0.0 110.694 -179.614 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -63.46 -54.67 32.82 Favored 'General case' 0 C--O 1.234 0.263 0 C-N-CA 125.258 1.423 . . . . 0.0 108.578 178.839 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 7.4 tp10 -59.16 -40.05 84.4 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 124.324 1.049 . . . . 0.0 110.48 -179.364 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -71.38 -37.24 71.59 Favored 'General case' 0 CA--C 1.53 0.199 0 C-N-CA 125.751 1.62 . . . . 0.0 111.713 179.704 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 22.7 t -76.67 -15.63 59.75 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 124.441 1.096 . . . . 0.0 111.393 179.784 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 77.54 34.43 39.91 Favored Glycine 0 CA--C 1.53 0.97 0 N-CA-C 110.017 -1.233 . . . . 0.0 110.017 -179.121 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 90.8 mt -136.49 132.69 35.66 Favored 'General case' 0 CA--C 1.514 -0.424 0 N-CA-C 106.735 -1.58 . . . . 0.0 106.735 179.792 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 6.7 t -62.68 150.91 39.77 Favored 'General case' 0 CA--C 1.537 0.471 0 N-CA-C 107.544 -1.28 . . . . 0.0 107.544 178.616 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 41.7 t -47.09 -45.13 8.3 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.446 0 C-N-CA 125.025 1.33 . . . . 0.0 111.513 -179.752 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 56.7 p -56.73 -45.5 81.9 Favored 'General case' 0 CA--C 1.535 0.39 0 CA-C-N 119.029 0.831 . . . . 0.0 111.922 -179.625 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -71.72 -44.33 64.34 Favored 'General case' 0 N--CA 1.449 -0.48 0 C-N-CA 124.369 1.068 . . . . 0.0 109.5 179.104 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 93.2 t80 -52.1 -48.75 64.6 Favored 'General case' 0 CA--C 1.53 0.182 0 C-N-CA 124.519 1.128 . . . . 0.0 109.196 179.79 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.508 HG23 HG23 ' B' ' 45' ' ' ILE . 24.2 mm -55.74 -66.61 0.27 Allowed 'Isoleucine or valine' 0 C--O 1.226 -0.143 0 C-N-CA 123.918 0.887 . . . . 0.0 111.411 179.626 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 15.7 ptt180 -58.54 -45.39 89.0 Favored 'General case' 0 C--O 1.219 -0.516 0 CA-C-O 118.398 -0.81 . . . . 0.0 112.001 -177.811 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 16.6 t30 -55.34 -47.72 75.27 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 119.153 0.888 . . . . 0.0 111.451 -179.41 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -67.51 -30.9 70.69 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 122.823 0.449 . . . . 0.0 111.896 179.452 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -77.58 -29.01 51.87 Favored 'General case' 0 N--CA 1.451 -0.418 0 C-N-CA 124.245 1.018 . . . . 0.0 113.432 -179.65 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 8.9 mt -89.23 -39.52 13.47 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 113.279 0.844 . . . . 0.0 113.279 -178.33 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 65.7 m-20 . . . . . 0 C--O 1.251 1.181 0 C-N-CA 123.566 0.746 . . . . 0.0 112.657 -178.446 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 1' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.484 1.242 0 CA-C-O 124.525 2.107 . . . . 0.0 105.579 . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 2' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -86.89 -56.19 3.5 Favored 'General case' 0 C--N 1.317 -0.812 1 C-N-CA 136.133 5.773 . . . . 0.0 107.858 -176.166 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 3' ' ' SER . . . . . . . . . . . . . 58.8 m -101.22 125.99 47.9 Favored 'General case' 0 N--CA 1.45 -0.462 0 N-CA-C 107.316 -1.365 . . . . 0.0 107.316 178.987 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 4' ' ' ALA . . . . . . . . . . . . . . . -143.92 143.59 31.33 Favored 'General case' 0 C--O 1.24 0.569 0 N-CA-C 107.592 -1.262 . . . . 0.0 107.592 179.292 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 12.4 p -54.96 144.49 6.04 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.313 0 C-N-CA 124.855 1.262 . . . . 0.0 110.014 -179.761 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 6' ' ' ARG . . . . . . . . . . . . . 17.2 ptp180 -159.47 158.54 32.17 Favored 'General case' 0 C--N 1.333 -0.115 0 C-N-CA 125.005 1.322 . . . . 0.0 107.537 -179.802 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 10.1 pttp -63.04 150.56 42.22 Favored 'General case' 0 C--O 1.233 0.213 0 O-C-N 123.353 0.408 . . . . 0.0 111.785 -179.324 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 1.4 tmtp? -140.0 -64.55 0.48 Allowed 'General case' 0 C--O 1.233 0.227 0 N-CA-C 107.87 -1.159 . . . . 0.0 107.87 178.898 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 5.4 m -135.25 175.22 9.78 Favored 'General case' 0 C--N 1.332 -0.172 0 C-N-CA 125.063 1.345 . . . . 0.0 110.234 179.9 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 10' ' ' GLU . . . . . . . . . . . . . 23.2 tt0 -148.31 179.66 7.61 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 124.93 1.292 . . . . 0.0 108.293 -179.842 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 11' ' ' VAL . . . . . . . . . . . . . 12.7 m -61.65 111.16 0.7 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.347 0 N-CA-C 108.056 -1.09 . . . . 0.0 108.056 179.273 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 12' ' ' ARG . . . . . . . . . . . . . 10.1 ptp85 -59.24 -32.26 69.81 Favored 'General case' 0 N--CA 1.464 0.262 0 N-CA-C 113.473 0.916 . . . . 0.0 113.473 -178.252 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 13' ' ' GLN . . . . . . . . . . . . . 9.7 tt0 -120.67 94.71 4.45 Favored 'General case' 0 N--CA 1.452 -0.333 0 N-CA-C 105.775 -1.935 . . . . 0.0 105.775 -179.58 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 19.5 ptmt -62.88 -32.7 74.01 Favored 'General case' 0 N--CA 1.455 -0.215 0 C-N-CA 124.137 0.975 . . . . 0.0 109.74 179.295 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 4.3 t -81.88 163.07 22.52 Favored 'General case' 0 N--CA 1.449 -0.5 0 N-CA-C 108.059 -1.089 . . . . 0.0 108.059 178.594 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 5.8 t -107.18 157.07 7.45 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 N-CA-C 106.34 -1.726 . . . . 0.0 106.34 178.405 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 10.9 p -151.21 120.4 0.87 Allowed 'Isoleucine or valine' 0 N--CA 1.444 -0.76 0 N-CA-C 105.017 -2.216 . . . . 0.0 105.017 178.585 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 4.9 ttt85 -145.96 175.67 10.27 Favored 'General case' 0 C--O 1.238 0.457 0 C-N-CA 119.646 -0.822 . . . . 0.0 111.702 -179.845 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 20.9 m -115.27 76.67 1.01 Allowed 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 106.708 -1.59 . . . . 0.0 106.708 -179.631 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 52.6 tp -89.52 93.16 9.39 Favored 'General case' 0 N--CA 1.448 -0.558 0 C-N-CA 127.362 2.265 . . . . 0.0 107.935 -179.212 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 41.2 mtt180 -76.89 164.56 25.69 Favored 'General case' 0 C--N 1.326 -0.44 0 C-N-CA 123.715 0.806 . . . . 0.0 110.963 -179.728 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 22' ' ' PHE . . . . . . . . . . . . . 69.3 m-85 -142.47 148.56 37.91 Favored 'General case' 0 C--O 1.237 0.395 0 N-CA-C 107.57 -1.27 . . . . 0.0 107.57 179.849 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 49.3 m -79.62 166.12 43.25 Favored Pre-proline 0 CA--C 1.541 0.612 0 N-CA-C 107.771 -1.196 . . . . 0.0 107.771 179.33 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 24' ' ' PRO . . . . . 0.465 ' HG3' ' HE3' ' A' ' 14' ' ' LYS . 55.2 Cg_endo -64.73 -35.43 46.21 Favored 'Trans proline' 0 C--N 1.348 0.517 0 C-N-CA 121.517 1.478 . . . . 0.0 112.118 -178.696 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 25' ' ' VAL . . . . . . . . . . . . . 89.4 t -60.62 -55.25 25.71 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.375 0 N-CA-C 108.219 -1.03 . . . . 0.0 108.219 179.392 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 4.2 mm-40 -59.92 -44.48 94.3 Favored 'General case' 0 CA--C 1.53 0.206 0 C-N-CA 125.338 1.455 . . . . 0.0 111.109 -178.977 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 27' ' ' ASP . . . . . . . . . . . . . 13.5 t70 -60.97 -46.08 92.17 Favored 'General case' 0 CA--C 1.514 -0.407 0 C-N-CA 125.64 1.576 . . . . 0.0 111.234 179.828 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 28' ' ' GLU . . . . . . . . . . . . . 87.6 tt0 -60.51 -48.18 82.9 Favored 'General case' 0 N--CA 1.448 -0.534 0 N-CA-C 108.387 -0.968 . . . . 0.0 108.387 179.098 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 39.2 m -57.02 -58.08 9.74 Favored 'General case' 0 CA--C 1.536 0.414 0 N-CA-C 109.449 -0.575 . . . . 0.0 109.449 179.522 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 63.4 mt -57.67 -44.02 84.75 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.314 0 C-N-CA 124.456 1.103 . . . . 0.0 111.093 -178.761 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 20.4 ttt180 -61.94 -49.55 75.69 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 119.133 0.879 . . . . 0.0 110.508 179.889 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 1.2 mptm? -62.75 -44.24 96.72 Favored 'General case' 0 CA--C 1.518 -0.252 0 O-C-N 123.463 0.477 . . . . 0.0 110.033 -178.102 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 36.3 tptt -67.94 -43.41 79.16 Favored 'General case' 0 C--O 1.221 -0.436 0 CA-C-O 118.714 -0.66 . . . . 0.0 111.155 -179.584 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 34' ' ' ALA . . . . . . . . . . . . . . . -57.64 -52.29 66.04 Favored 'General case' 0 C--N 1.329 -0.286 0 C-N-CA 124.029 0.932 . . . . 0.0 110.646 179.819 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 31.1 tp10 -63.36 -37.51 87.55 Favored 'General case' 0 CA--C 1.534 0.331 0 N-CA-C 110.46 -0.2 . . . . 0.0 110.46 -178.841 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 36' ' ' ASP . . . . . . . . . . . . . 34.8 t70 -69.28 -41.34 76.98 Favored 'General case' 0 C--O 1.232 0.156 0 C-N-CA 124.419 1.088 . . . . 0.0 111.038 179.741 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 37' ' ' SER . . . . . . . . . . . . . 1.4 t -70.16 -27.17 64.32 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 124.253 1.021 . . . . 0.0 108.886 179.23 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 85.71 22.4 50.26 Favored Glycine 0 CA--C 1.53 1.007 0 N-CA-C 109.959 -1.257 . . . . 0.0 109.959 -178.933 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 39' ' ' LEU . . . . . . . . . . . . . 86.9 mt -122.99 115.0 21.17 Favored 'General case' 0 CA--C 1.508 -0.661 0 N-CA-C 104.034 -2.58 . . . . 0.0 104.034 -179.823 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 40' ' ' THR . . . . . . . . . . . . . 9.0 t -51.9 158.57 1.01 Allowed 'General case' 0 CA--C 1.534 0.345 0 N-CA-C 109.741 -0.466 . . . . 0.0 109.741 179.299 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 41' ' ' VAL . . . . . . . . . . . . . 94.4 t -46.64 -42.11 5.38 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.294 0 C-N-CA 124.201 1.0 . . . . 0.0 112.086 -178.899 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 42' ' ' SER . . . . . 0.451 ' HA ' HD21 ' A' ' 20' ' ' LEU . 19.4 p -64.33 -46.79 81.96 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-N 120.516 1.507 . . . . 0.0 112.109 179.704 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.61 -46.46 85.64 Favored 'General case' 0 C--O 1.222 -0.389 0 C-N-CA 124.23 1.012 . . . . 0.0 108.721 179.119 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 44' ' ' TYR . . . . . . . . . . . . . 82.7 t80 -55.07 -52.98 61.52 Favored 'General case' 0 N--CA 1.447 -0.576 0 C-N-CA 124.399 1.08 . . . . 0.0 109.081 179.426 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 45' ' ' ILE . . . . . 0.508 HG23 HG23 ' A' ' 45' ' ' ILE . 11.0 mm -55.89 -62.25 0.89 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.25 0 C-N-CA 124.688 1.195 . . . . 0.0 111.504 179.781 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 46' ' ' ARG . . . . . . . . . . . . . 22.4 ptt180 -58.67 -39.27 80.15 Favored 'General case' 0 N--CA 1.454 -0.262 0 CA-C-O 117.809 -1.091 . . . . 0.0 112.847 -177.69 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 47' ' ' ASN . . . . . . . . . . . . . 29.2 t30 -65.12 -56.01 15.44 Favored 'General case' 0 C--N 1.332 -0.162 0 C-N-CA 124.255 1.022 . . . . 0.0 109.409 179.212 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -56.9 -29.27 62.86 Favored 'General case' 0 N--CA 1.454 -0.274 0 C-N-CA 124.453 1.101 . . . . 0.0 112.055 -179.385 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 49' ' ' ALA . . . . . . . . . . . . . . . -75.08 -25.6 58.69 Favored 'General case' 0 N--CA 1.445 -0.714 0 N-CA-C 113.748 1.018 . . . . 0.0 113.748 179.982 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 10.7 mt -93.72 -44.79 7.98 Favored 'General case' 0 C--O 1.238 0.461 0 C-N-CA 123.373 0.669 . . . . 0.0 109.226 -179.847 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 51' ' ' ASN . . . . . . . . . . . . . 73.0 m-20 . . . . . 0 C--O 1.251 1.132 0 C-N-CA 125.558 1.543 . . . . 0.0 109.99 -179.751 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 10.8 m . . . . . 0 CA--C 1.511 -0.534 0 N-CA-C 107.624 -1.25 . . . . 0.0 107.624 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -77.31 81.32 3.8 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 105.892 -1.892 . . . . 0.0 105.892 179.828 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 60.7 m -114.32 123.33 49.25 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 124.48 1.112 . . . . 0.0 110.253 -178.664 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -144.28 141.78 30.02 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 123.551 0.74 . . . . 0.0 110.396 -179.818 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 34.5 m -140.12 155.97 24.39 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.309 0 C-N-CA 124.329 1.052 . . . . 0.0 108.953 179.392 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 27.7 mmt85 -137.43 22.52 2.95 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 125.496 1.519 . . . . 0.0 107.579 177.404 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 15.8 mmtp -65.47 164.04 14.69 Favored 'General case' 0 C--O 1.238 0.461 0 CA-C-O 121.831 0.824 . . . . 0.0 108.933 179.651 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 41.0 mtmt -135.14 161.33 35.65 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 106.159 -1.793 . . . . 0.0 106.159 179.287 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 22.5 p -139.47 -1.64 1.67 Allowed 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 112.328 0.492 . . . . 0.0 112.328 -179.615 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' GLU . . . . . 0.455 ' HB2' HH11 ' A' ' 12' ' ' ARG . 1.8 pm0 -91.98 148.21 22.37 Favored 'General case' 0 N--CA 1.45 -0.437 0 O-C-N 121.647 -0.658 . . . . 0.0 109.742 179.563 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 8.3 p -157.78 -20.96 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.538 0.513 0 C-N-CA 124.584 1.153 . . . . 0.0 111.765 -179.588 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' ARG . . . . . 0.455 HH11 ' HB2' ' A' ' 10' ' ' GLU . 0.1 OUTLIER 49.14 42.26 21.01 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 125.537 1.535 . . . . 0.0 112.176 -179.301 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 6.6 tt0 -113.27 117.49 31.99 Favored 'General case' 0 C--N 1.33 -0.251 0 C-N-CA 125.263 1.425 . . . . 0.0 107.589 179.564 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 21.1 pttm -84.56 -31.65 24.24 Favored 'General case' 0 CA--C 1.535 0.381 0 N-CA-C 109.434 -0.58 . . . . 0.0 109.434 177.97 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 2.8 t -80.19 -174.06 4.32 Favored 'General case' 0 N--CA 1.446 -0.673 0 C-N-CA 125.322 1.449 . . . . 0.0 108.253 179.546 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 0.407 HG21 ' HB2' ' B' ' 27' ' ' ASP . 6.2 t -132.48 148.74 31.78 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.657 0 N-CA-C 105.65 -1.982 . . . . 0.0 105.65 178.963 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 14.8 p -139.1 112.96 6.92 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.038 0 N-CA-C 105.815 -1.92 . . . . 0.0 105.815 178.02 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 17.7 ttt180 -140.93 178.81 7.1 Favored 'General case' 0 C--O 1.236 0.388 0 N-CA-C 107.549 -1.278 . . . . 0.0 107.549 -179.635 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 6.4 m -116.77 108.03 15.38 Favored 'General case' 0 C--O 1.237 0.414 0 N-CA-C 106.91 -1.515 . . . . 0.0 106.91 179.765 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.412 HD12 ' CZ ' ' A' ' 22' ' ' PHE . 0.0 OUTLIER -96.49 99.77 11.41 Favored 'General case' 0 C--O 1.235 0.308 0 N-CA-C 108.435 -0.95 . . . . 0.0 108.435 -178.94 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 1.2 mmt-85 -81.65 154.9 25.88 Favored 'General case' 0 C--O 1.235 0.316 0 C-N-CA 123.36 0.664 . . . . 0.0 109.484 179.094 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' PHE . . . . . 0.412 ' CZ ' HD12 ' A' ' 20' ' ' LEU . 96.9 m-85 -148.05 152.84 38.07 Favored 'General case' 0 CA--C 1.516 -0.344 0 C-N-CA 124.206 1.002 . . . . 0.0 108.644 178.633 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 14.5 m -79.49 167.04 37.25 Favored Pre-proline 0 CA--C 1.545 0.76 0 N-CA-C 107.496 -1.298 . . . . 0.0 107.496 178.603 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 34.5 Cg_endo -63.38 -43.01 19.41 Favored 'Trans proline' 0 N--CA 1.461 -0.418 0 C-N-CA 121.515 1.477 . . . . 0.0 112.025 -178.713 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 60.7 t -66.49 -39.36 83.81 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.557 0 C-N-CA 124.198 0.999 . . . . 0.0 109.921 179.795 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 97.5 mt-10 -63.7 -41.45 98.12 Favored 'General case' 0 N--CA 1.465 0.279 0 O-C-N 121.209 -0.932 . . . . 0.0 109.731 179.707 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' ASP . . . . . 0.502 ' HB2' HG21 ' B' ' 16' ' ' VAL . 27.1 t70 -68.19 -47.51 67.74 Favored 'General case' 0 C--O 1.218 -0.595 0 C-N-CA 124.445 1.098 . . . . 0.0 110.719 179.442 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -58.01 -34.26 69.83 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 118.692 0.678 . . . . 0.0 109.268 178.794 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 39.5 m -70.88 -60.71 2.09 Favored 'General case' 0 N--CA 1.45 -0.433 0 O-C-N 121.795 -0.566 . . . . 0.0 109.614 179.309 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 51.0 mt -58.73 -42.6 85.74 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.295 0 C-N-CA 123.765 0.826 . . . . 0.0 111.814 -178.247 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 59.7 ttt180 -64.27 -44.83 90.5 Favored 'General case' 0 N--CA 1.448 -0.538 0 CA-C-O 117.336 -1.316 . . . . 0.0 110.539 -179.481 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 2.1 mptp? -68.03 -44.73 75.8 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-N 119.863 1.211 . . . . 0.0 109.282 179.536 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 37.0 mmtt -55.93 -49.17 74.24 Favored 'General case' 0 CA--C 1.518 -0.253 0 C-N-CA 123.686 0.795 . . . . 0.0 110.609 -179.779 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -59.41 -53.8 54.05 Favored 'General case' 0 N--CA 1.444 -0.76 0 C-N-CA 125.419 1.487 . . . . 0.0 110.264 179.897 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 25.7 tt0 -57.76 -41.26 81.58 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 123.761 0.824 . . . . 0.0 110.805 -179.498 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 29.2 t70 -68.34 -40.24 81.61 Favored 'General case' 0 N--CA 1.463 0.201 0 C-N-CA 125.452 1.501 . . . . 0.0 109.95 179.663 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 22.5 t -73.06 -15.39 61.51 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 123.817 0.847 . . . . 0.0 109.647 178.356 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 75.21 0.82 62.34 Favored Glycine 0 CA--C 1.533 1.207 0 O-C-N 120.817 -1.177 . . . . 0.0 110.161 -178.189 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 40.7 mt -96.53 114.41 26.07 Favored 'General case' 0 N--CA 1.449 -0.49 0 N-CA-C 104.713 -2.329 . . . . 0.0 104.713 179.543 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 4.3 t -51.66 153.78 2.23 Favored 'General case' 0 CA--C 1.539 0.531 0 N-CA-C 109.475 -0.565 . . . . 0.0 109.475 179.336 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 55.8 t -44.88 -42.79 2.48 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.124 0 C-N-CA 124.964 1.306 . . . . 0.0 112.205 -178.805 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 1.6 p -63.22 -45.54 91.17 Favored 'General case' 0 CA--C 1.536 0.416 0 CA-C-N 119.034 0.834 . . . . 0.0 112.032 179.859 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -65.97 -45.37 81.93 Favored 'General case' 0 C--O 1.222 -0.38 0 C-N-CA 123.7 0.8 . . . . 0.0 109.083 178.777 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 65.1 t80 -56.07 -52.04 65.69 Favored 'General case' 0 N--CA 1.452 -0.361 0 C-N-CA 124.702 1.201 . . . . 0.0 109.11 179.888 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 3.9 mm -54.79 -62.66 0.7 Allowed 'Isoleucine or valine' 0 N--CA 1.457 -0.087 0 C-N-CA 124.91 1.284 . . . . 0.0 110.588 179.782 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 14.5 ptt180 -58.36 -46.66 85.87 Favored 'General case' 0 C--O 1.222 -0.369 0 CA-C-O 118.311 -0.852 . . . . 0.0 111.368 -178.195 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 22.0 t30 -56.66 -54.57 44.52 Favored 'General case' 0 C--O 1.225 -0.205 0 CA-C-N 119.181 0.901 . . . . 0.0 110.251 -179.748 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -60.25 -33.78 72.78 Favored 'General case' 0 N--CA 1.452 -0.337 0 N-CA-C 112.409 0.522 . . . . 0.0 112.409 -179.45 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -72.24 -40.89 67.39 Favored 'General case' 0 C--O 1.232 0.182 0 N-CA-C 113.049 0.759 . . . . 0.0 113.049 -179.154 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 14.7 mt -85.04 -37.03 20.83 Favored 'General case' 0 C--N 1.331 -0.232 0 C-N-CA 124.334 1.054 . . . . 0.0 113.295 -177.938 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 72.6 m-80 . . . . . 0 C--O 1.259 1.595 0 N-CA-C 113.684 0.994 . . . . 0.0 113.684 -177.095 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 1' ' ' SER . . . . . . . . . . . . . 6.3 m . . . . . 0 CA--C 1.511 -0.542 0 N-CA-C 107.483 -1.303 . . . . 0.0 107.483 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 2' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -84.23 49.6 1.69 Allowed 'General case' 0 C--N 1.324 -0.526 0 C-N-CA 126.477 1.911 . . . . 0.0 108.279 -179.073 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 3' ' ' SER . . . . . . . . . . . . . 13.8 m -69.04 134.76 49.86 Favored 'General case' 0 N--CA 1.443 -0.808 0 C-N-CA 127.681 2.393 . . . . 0.0 109.196 -179.426 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 4' ' ' ALA . . . . . . . . . . . . . . . -140.79 114.51 8.91 Favored 'General case' 0 N--CA 1.452 -0.358 0 N-CA-C 108.6 -0.889 . . . . 0.0 108.6 -179.884 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 20.9 m -129.08 141.58 46.25 Favored 'Isoleucine or valine' 0 C--O 1.234 0.243 0 C-N-CA 124.935 1.294 . . . . 0.0 107.878 179.372 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 6' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -134.21 41.36 2.97 Favored 'General case' 0 C--O 1.236 0.392 0 C-N-CA 125.58 1.552 . . . . 0.0 110.972 -179.798 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 6.0 mptp? -77.96 -177.49 5.01 Favored 'General case' 0 C--N 1.327 -0.393 0 C-N-CA 125.468 1.507 . . . . 0.0 108.409 178.87 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 2.1 mtmm -149.17 166.28 29.3 Favored 'General case' 0 C--O 1.239 0.527 0 C-N-CA 127.797 2.439 . . . . 0.0 105.843 178.328 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 14.1 p -143.34 -13.39 0.7 Allowed 'General case' 0 C--N 1.33 -0.254 0 N-CA-C 114.825 1.417 . . . . 0.0 114.825 -178.95 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 10' ' ' GLU . . . . . . . . . . . . . 1.2 pm0 -81.63 94.95 7.04 Favored 'General case' 0 N--CA 1.456 -0.155 0 C-N-CA 125.798 1.639 . . . . 0.0 110.985 -179.3 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 11' ' ' VAL . . . . . . . . . . . . . 19.6 m -93.72 -11.89 8.94 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.439 0 O-C-N 121.327 -0.858 . . . . 0.0 112.662 179.769 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 12' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER 43.89 58.33 3.67 Favored 'General case' 0 N--CA 1.469 0.496 0 C-N-CA 125.272 1.429 . . . . 0.0 111.627 -179.63 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 13' ' ' GLN . . . . . . . . . . . . . 12.9 tt0 -140.43 115.75 9.95 Favored 'General case' 0 C--O 1.235 0.327 0 C-N-CA 125.114 1.366 . . . . 0.0 109.258 -179.234 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 23.5 pttm -80.15 -42.47 23.38 Favored 'General case' 0 N--CA 1.462 0.147 0 N-CA-C 109.254 -0.647 . . . . 0.0 109.254 178.748 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 10.5 t -69.13 178.51 2.26 Favored 'General case' 0 N--CA 1.449 -0.486 0 C-N-CA 124.597 1.159 . . . . 0.0 108.302 179.169 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 16' ' ' VAL . . . . . 0.502 HG21 ' HB2' ' A' ' 27' ' ' ASP . 5.6 t -125.43 145.62 32.49 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.588 0 N-CA-C 106.518 -1.66 . . . . 0.0 106.518 179.575 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 9.4 p -137.82 119.1 17.43 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.365 0 N-CA-C 108.46 -0.941 . . . . 0.0 108.46 -179.932 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 17.8 ttt180 -149.43 157.9 43.7 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-O 120.519 0.2 . . . . 0.0 110.814 179.073 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 1.6 m -94.96 93.84 7.65 Favored 'General case' 0 N--CA 1.451 -0.413 0 C-N-CA 125.28 1.432 . . . . 0.0 107.917 179.934 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -95.49 94.8 8.0 Favored 'General case' 0 C--N 1.327 -0.409 0 C-N-CA 124.574 1.15 . . . . 0.0 108.869 -179.654 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 20.5 mmm-85 -76.47 147.68 37.71 Favored 'General case' 0 C--O 1.239 0.514 0 N-CA-C 108.799 -0.815 . . . . 0.0 108.799 179.273 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 22' ' ' PHE . . . . . . . . . . . . . 92.3 m-85 -136.0 153.46 51.37 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 124.674 1.19 . . . . 0.0 108.796 179.541 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 18.7 m -82.04 168.7 22.09 Favored Pre-proline 0 CA--C 1.541 0.614 0 C-N-CA 124.313 1.045 . . . . 0.0 109.74 179.232 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 24' ' ' PRO . . . . . . . . . . . . . 33.0 Cg_endo -64.36 -36.58 44.27 Favored 'Trans proline' 0 C--N 1.349 0.582 0 C-N-CA 121.658 1.572 . . . . 0.0 111.205 -179.391 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 25' ' ' VAL . . . . . . . . . . . . . 86.0 t -66.34 -45.54 89.27 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.211 0 N-CA-C 108.35 -0.981 . . . . 0.0 108.35 179.02 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 96.7 mt-10 -60.9 -49.58 76.88 Favored 'General case' 0 N--CA 1.455 -0.21 0 C-N-CA 123.62 0.768 . . . . 0.0 110.856 -179.319 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 27' ' ' ASP . . . . . 0.407 ' HB2' HG21 ' A' ' 16' ' ' VAL . 33.6 t70 -60.31 -53.27 59.65 Favored 'General case' 0 CA--C 1.502 -0.871 0 CA-C-O 117.401 -1.285 . . . . 0.0 111.751 -179.365 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 28' ' ' GLU . . . . . . . . . . . . . 24.2 mm-40 -57.53 -44.37 85.06 Favored 'General case' 0 N--CA 1.454 -0.258 0 CA-C-N 118.855 0.752 . . . . 0.0 109.012 -179.442 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 30.6 m -58.15 -53.05 62.65 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-N 118.536 0.607 . . . . 0.0 110.45 179.966 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 57.7 mt -61.74 -44.48 98.83 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.269 0 C-N-CA 124.323 1.049 . . . . 0.0 110.831 -179.414 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 24.7 ttt180 -62.62 -46.34 88.7 Favored 'General case' 0 C--N 1.325 -0.486 0 C-N-CA 126.204 1.801 . . . . 0.0 111.32 -178.902 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 4.7 mptp? -66.78 -42.84 85.41 Favored 'General case' 0 CA--C 1.518 -0.253 0 N-CA-C 108.9 -0.778 . . . . 0.0 108.9 -179.561 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 39.3 mmtt -63.15 -53.34 54.91 Favored 'General case' 0 C--O 1.222 -0.389 0 C-N-CA 123.496 0.718 . . . . 0.0 109.93 179.219 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 34' ' ' ALA . . . . . . . . . . . . . . . -52.51 -50.6 62.47 Favored 'General case' 0 C--O 1.236 0.359 0 C-N-CA 124.836 1.254 . . . . 0.0 111.394 -178.826 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -63.76 -39.95 95.51 Favored 'General case' 0 CA--C 1.532 0.258 0 CA-C-O 119.195 -0.431 . . . . 0.0 111.822 -179.573 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 36' ' ' ASP . . . . . . . . . . . . . 37.6 t70 -75.08 -30.73 61.02 Favored 'General case' 0 N--CA 1.465 0.317 0 C-N-CA 123.959 0.904 . . . . 0.0 112.931 -178.285 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 37' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -86.99 -6.13 58.86 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-O 118.156 -0.926 . . . . 0.0 112.459 -179.488 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 75.89 14.35 82.26 Favored Glycine 0 CA--C 1.534 1.262 0 CA-C-N 119.87 1.214 . . . . 0.0 114.172 179.348 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 39' ' ' LEU . . . . . . . . . . . . . 20.9 mt -121.68 112.27 18.22 Favored 'General case' 0 CA--C 1.517 -0.316 0 N-CA-C 105.828 -1.916 . . . . 0.0 105.828 179.623 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 40' ' ' THR . . . . . . . . . . . . . 14.1 t -52.05 156.11 1.67 Allowed 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 124.702 1.201 . . . . 0.0 109.561 179.163 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 41' ' ' VAL . . . . . . . . . . . . . 78.2 t -44.62 -47.39 2.61 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.232 0 C-N-CA 125.216 1.406 . . . . 0.0 112.566 -177.951 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 42' ' ' SER . . . . . . . . . . . . . 14.1 m -63.15 -47.45 82.63 Favored 'General case' 0 CA--C 1.543 0.696 0 CA-C-N 118.792 0.724 . . . . 0.0 111.523 -179.432 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -65.04 -43.3 92.84 Favored 'General case' 0 C--O 1.22 -0.476 0 C-N-CA 124.475 1.11 . . . . 0.0 109.788 178.644 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 44' ' ' TYR . . . . . . . . . . . . . 80.8 t80 -53.79 -53.72 48.35 Favored 'General case' 0 N--CA 1.455 -0.183 0 C-N-CA 125.515 1.526 . . . . 0.0 108.551 179.447 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 45' ' ' ILE . . . . . . . . . . . . . 18.5 mm -54.7 -61.21 1.07 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.226 0 C-N-CA 123.948 0.899 . . . . 0.0 111.202 179.595 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 46' ' ' ARG . . . . . . . . . . . . . 29.0 ptt180 -57.7 -45.23 85.98 Favored 'General case' 0 N--CA 1.466 0.374 0 O-C-N 121.975 -0.453 . . . . 0.0 111.345 -178.324 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 47' ' ' ASN . . . . . . . . . . . . . 35.2 t30 -57.91 -55.63 32.39 Favored 'General case' 0 N--CA 1.449 -0.504 0 C-N-CA 123.697 0.799 . . . . 0.0 111.436 -179.389 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -62.29 -32.01 72.68 Favored 'General case' 0 CA--C 1.529 0.171 0 C-N-CA 124.313 1.045 . . . . 0.0 112.385 -179.656 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 49' ' ' ALA . . . . . . . . . . . . . . . -77.14 -40.91 43.88 Favored 'General case' 0 N--CA 1.451 -0.394 0 N-CA-C 113.195 0.813 . . . . 0.0 113.195 -178.75 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 22.8 mt -74.18 -43.18 58.28 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 118.467 0.576 . . . . 0.0 111.685 -178.919 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 51' ' ' ASN . . . . . . . . . . . . . 53.3 m-80 . . . . . 0 C--O 1.254 1.326 0 CA-C-O 117.951 -1.023 . . . . 0.0 110.927 -179.785 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 10.2 m . . . . . 0 CA--C 1.514 -0.435 0 N-CA-C 107.33 -1.359 . . . . 0.0 107.33 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 4.4 p-10 -144.16 -149.76 0.29 Allowed 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 126.592 1.957 . . . . 0.0 106.381 -179.412 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 23.4 m -147.48 17.03 1.16 Allowed 'General case' 0 CA--C 1.539 0.529 0 CA-C-N 120.672 1.578 . . . . 0.0 113.089 179.895 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -59.55 -18.48 41.01 Favored 'General case' 0 CA--C 1.53 0.199 0 C-N-CA 124.384 1.074 . . . . 0.0 113.655 -179.543 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 14.1 p -52.31 -26.91 9.78 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.661 0 C-N-CA 124.806 1.242 . . . . 0.0 111.849 179.341 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 31.2 ptt85 -69.28 -0.84 6.76 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 124.552 1.141 . . . . 0.0 113.796 179.309 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 15.9 pttp -143.01 120.88 11.96 Favored 'General case' 0 C--O 1.227 -0.081 0 CA-C-N 119.909 1.232 . . . . 0.0 110.067 -179.86 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 50.8 mtmt -92.6 1.77 57.07 Favored 'General case' 0 N--CA 1.469 0.512 0 O-C-N 121.405 -0.81 . . . . 0.0 110.671 178.586 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 16.4 p -149.7 -179.95 7.52 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 127.111 2.165 . . . . 0.0 109.26 -179.482 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 39.2 mt-10 -134.02 173.27 11.75 Favored 'General case' 0 CA--C 1.528 0.117 0 C-N-CA 124.399 1.08 . . . . 0.0 111.053 -178.961 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 3.0 m -124.31 102.02 10.11 Favored 'Isoleucine or valine' 0 C--O 1.234 0.264 0 N-CA-C 106.104 -1.813 . . . . 0.0 106.104 178.945 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 14.5 ptp180 -164.17 123.97 2.03 Favored 'General case' 0 C--O 1.236 0.36 0 C-N-CA 127.518 2.327 . . . . 0.0 105.269 179.449 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 59.5 mt-30 -105.41 87.45 2.62 Favored 'General case' 0 N--CA 1.443 -0.799 0 N-CA-C 105.396 -2.076 . . . . 0.0 105.396 -178.695 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 5.7 ptpt -58.31 -22.81 54.46 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-N 114.612 -1.177 . . . . 0.0 112.841 179.933 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 4.8 t -84.74 160.99 20.18 Favored 'General case' 0 N--CA 1.447 -0.62 0 N-CA-C 109.333 -0.618 . . . . 0.0 109.333 178.774 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 9.3 t -109.96 84.5 0.73 Allowed 'Isoleucine or valine' 0 CA--C 1.513 -0.448 0 N-CA-C 109.765 -0.457 . . . . 0.0 109.765 -179.663 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 11.8 p -83.24 121.01 35.55 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.498 0 N-CA-C 105.502 -2.036 . . . . 0.0 105.502 178.107 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 13.0 ttt85 -157.07 163.21 39.26 Favored 'General case' 0 C--O 1.236 0.39 0 N-CA-C 107.79 -1.189 . . . . 0.0 107.79 179.042 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 2.2 m -102.14 130.71 48.84 Favored 'General case' 0 C--N 1.327 -0.413 0 N-CA-C 106.716 -1.587 . . . . 0.0 106.716 179.698 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -130.43 125.87 35.55 Favored 'General case' 0 N--CA 1.448 -0.533 0 N-CA-C 107.005 -1.48 . . . . 0.0 107.005 179.171 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 15.2 mtp180 -107.21 155.55 19.79 Favored 'General case' 0 N--CA 1.455 -0.219 0 C-N-CA 124.306 1.042 . . . . 0.0 111.136 179.666 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 35.5 m-85 -133.73 -171.41 2.71 Favored 'General case' 0 C--O 1.236 0.365 0 C-N-CA 125.567 1.547 . . . . 0.0 108.512 179.787 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 1.2 m -118.18 175.75 1.95 Allowed Pre-proline 0 CA--C 1.539 0.542 0 CA-C-O 117.218 -1.373 . . . . 0.0 107.668 179.433 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_endo -65.0 -51.06 1.77 Allowed 'Trans proline' 0 N--CA 1.458 -0.574 0 CA-C-N 121.458 1.556 . . . . 0.0 111.869 -178.368 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 57.9 t -59.46 -44.3 92.48 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.268 0 C-N-CA 124.713 1.205 . . . . 0.0 111.002 -179.823 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 3.9 mm-40 -65.8 -48.19 72.57 Favored 'General case' 0 C--N 1.331 -0.201 0 C-N-CA 123.852 0.861 . . . . 0.0 110.351 -178.572 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 7.6 t70 -61.42 -43.5 98.77 Favored 'General case' 0 CA--C 1.514 -0.431 0 C-N-CA 124.176 0.99 . . . . 0.0 110.865 179.641 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 45.6 tt0 -61.85 -48.76 79.1 Favored 'General case' 0 N--CA 1.448 -0.554 0 C-N-CA 125.035 1.334 . . . . 0.0 108.568 179.697 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 79.8 m -56.79 -51.72 67.83 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 123.378 0.671 . . . . 0.0 109.222 179.185 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 82.3 mt -62.86 -41.66 93.46 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.41 0 C-N-CA 123.592 0.757 . . . . 0.0 110.296 -179.372 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 14.9 ttt180 -62.44 -52.22 64.39 Favored 'General case' 0 CA--C 1.517 -0.291 0 O-C-N 121.042 -1.036 . . . . 0.0 110.083 -179.928 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 5.0 mptp? -57.69 -47.85 81.2 Favored 'General case' 0 N--CA 1.452 -0.33 0 CA-C-O 118.626 -0.702 . . . . 0.0 109.348 -179.113 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 50.4 mttp -68.46 -35.12 77.11 Favored 'General case' 0 C--O 1.223 -0.29 0 CA-C-O 117.871 -1.061 . . . . 0.0 111.952 -179.173 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -60.81 -52.44 65.08 Favored 'General case' 0 C--N 1.332 -0.162 0 N-CA-C 106.845 -1.539 . . . . 0.0 106.845 177.844 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 8.5 tt0 -62.39 -38.96 91.64 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-N 115.856 -0.611 . . . . 0.0 111.728 -179.389 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 49.6 t0 -66.02 -42.68 89.31 Favored 'General case' 0 N--CA 1.466 0.355 0 N-CA-C 107.959 -1.126 . . . . 0.0 107.959 179.022 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 20.8 t -61.6 -33.27 73.62 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 125.488 1.515 . . . . 0.0 108.102 178.885 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 91.27 38.23 6.02 Favored Glycine 0 N--CA 1.447 -0.583 0 N-CA-C 107.776 -2.13 . . . . 0.0 107.776 -179.032 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 69.1 mt -138.56 159.31 42.42 Favored 'General case' 0 N--CA 1.447 -0.592 0 C-N-CA 126.596 1.958 . . . . 0.0 108.92 -179.17 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 1.7 t -82.37 154.81 25.05 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 104.698 -2.334 . . . . 0.0 104.698 176.906 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 37.4 t -44.93 -42.78 2.51 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.428 0 C-N-CA 126.466 1.907 . . . . 0.0 110.598 178.796 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 6.7 p -58.74 -51.86 68.17 Favored 'General case' 0 CA--C 1.531 0.244 0 CA-C-N 119.66 1.118 . . . . 0.0 111.644 179.52 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -61.15 -47.78 84.64 Favored 'General case' 0 N--CA 1.455 -0.196 0 C-N-CA 124.728 1.211 . . . . 0.0 109.731 179.195 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 77.3 t80 -55.32 -47.17 76.05 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 124.369 1.068 . . . . 0.0 109.5 179.581 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 3.0 mm -57.42 -66.53 0.32 Allowed 'Isoleucine or valine' 0 C--O 1.225 -0.225 0 C-N-CA 125.267 1.427 . . . . 0.0 110.03 179.327 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 9.2 ptm180 -54.37 -40.98 68.64 Favored 'General case' 0 C--O 1.22 -0.472 0 CA-C-O 118.001 -1.0 . . . . 0.0 112.914 -178.501 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 34.9 t30 -68.97 -45.12 71.47 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 119.642 1.11 . . . . 0.0 112.4 -179.339 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -64.76 -33.4 75.9 Favored 'General case' 0 C--O 1.224 -0.288 0 CA-C-N 118.468 0.576 . . . . 0.0 109.943 178.869 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -72.84 -14.25 61.46 Favored 'General case' 0 N--CA 1.453 -0.305 0 C-N-CA 124.199 0.999 . . . . 0.0 112.99 -179.375 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 20.7 mt -100.47 -40.88 7.23 Favored 'General case' 0 CA--C 1.509 -0.626 0 CA-C-O 118.277 -0.868 . . . . 0.0 109.9 178.826 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 70.0 m-80 . . . . . 0 C--O 1.251 1.178 0 O-C-N 124.455 1.097 . . . . 0.0 110.687 179.519 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 1' ' ' SER . . . . . . . . . . . . . 13.0 m . . . . . 0 CA--C 1.515 -0.38 0 N-CA-C 107.39 -1.337 . . . . 0.0 107.39 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 2' ' ' ASP . . . . . . . . . . . . . 6.4 p-10 -149.26 -153.92 0.52 Allowed 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 126.745 2.018 . . . . 0.0 107.076 -178.833 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 3' ' ' SER . . . . . . . . . . . . . 19.4 m -145.09 13.74 1.45 Allowed 'General case' 0 CA--C 1.541 0.606 0 CA-C-N 120.076 1.307 . . . . 0.0 113.489 179.947 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 4' ' ' ALA . . . . . . . . . . . . . . . -58.44 -22.79 55.6 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 124.871 1.268 . . . . 0.0 112.105 179.806 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 14.5 p -53.71 -20.88 4.1 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.555 0 C-N-CA 126.437 1.895 . . . . 0.0 112.337 179.323 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 6' ' ' ARG . . . . . . . . . . . . . 52.7 ptt85 -59.74 -15.8 22.7 Favored 'General case' 0 CA--C 1.535 0.383 0 O-C-N 120.931 -1.106 . . . . 0.0 113.172 179.171 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 16.9 pttp -143.75 158.59 43.57 Favored 'General case' 0 CA--C 1.528 0.1 0 C-N-CA 126.137 1.775 . . . . 0.0 107.508 -179.647 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 21.3 mtmt -112.27 4.7 17.91 Favored 'General case' 0 N--CA 1.465 0.32 0 C-N-CA 123.686 0.794 . . . . 0.0 112.906 -179.113 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 17.0 p -155.87 163.23 40.04 Favored 'General case' 0 C--O 1.238 0.489 0 C-N-CA 124.972 1.309 . . . . 0.0 108.668 179.32 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 10' ' ' GLU . . . . . . . . . . . . . 34.7 mt-10 -101.18 -175.53 2.89 Favored 'General case' 0 C--O 1.243 0.744 0 C-N-CA 125.261 1.424 . . . . 0.0 110.1 179.421 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 11' ' ' VAL . . . . . . . . . . . . . 16.3 t -137.49 91.54 0.81 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.549 0 C-N-CA 126.091 1.756 . . . . 0.0 107.967 -179.872 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 12' ' ' ARG . . . . . . . . . . . . . 17.2 mtp180 -138.73 169.0 18.59 Favored 'General case' 0 N--CA 1.468 0.43 0 C-N-CA 125.592 1.557 . . . . 0.0 109.426 179.331 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 13' ' ' GLN . . . . . . . . . . . . . 47.9 mt-30 -133.38 91.41 2.86 Favored 'General case' 0 N--CA 1.451 -0.383 0 C-N-CA 125.681 1.593 . . . . 0.0 107.019 179.111 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 20.9 ptmt -67.52 -17.74 64.78 Favored 'General case' 0 CA--C 1.536 0.421 0 N-CA-C 112.97 0.73 . . . . 0.0 112.97 179.305 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 10.9 t -92.46 -173.51 3.41 Favored 'General case' 0 N--CA 1.45 -0.458 0 C-N-CA 125.497 1.519 . . . . 0.0 108.435 178.522 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 2.8 t -136.12 88.9 0.75 Allowed 'Isoleucine or valine' 0 N--CA 1.447 -0.594 0 N-CA-C 106.948 -1.501 . . . . 0.0 106.948 -179.593 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 8.3 p -85.5 103.7 12.68 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.447 0 N-CA-C 104.751 -2.314 . . . . 0.0 104.751 178.689 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 36.1 ttt85 -137.66 165.57 26.06 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 108.376 -0.972 . . . . 0.0 108.376 -179.669 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 35.1 m -112.67 120.66 42.31 Favored 'General case' 0 N--CA 1.449 -0.483 0 N-CA-C 105.275 -2.12 . . . . 0.0 105.275 179.696 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -118.75 111.71 18.82 Favored 'General case' 0 CA--C 1.517 -0.317 0 C-N-CA 123.699 0.799 . . . . 0.0 109.686 -178.242 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 62.0 mtm180 -90.08 153.91 20.19 Favored 'General case' 0 N--CA 1.454 -0.259 0 CA-C-O 121.225 0.536 . . . . 0.0 111.283 179.362 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 22' ' ' PHE . . . . . . . . . . . . . 63.9 m-85 -139.33 162.36 35.19 Favored 'General case' 0 C--O 1.235 0.298 0 C-N-CA 126.833 2.053 . . . . 0.0 107.256 -179.588 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -94.86 177.82 1.7 Allowed Pre-proline 0 CA--C 1.546 0.824 0 N-CA-C 108.463 -0.939 . . . . 0.0 108.463 179.069 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 24' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -71.32 -23.47 24.03 Favored 'Trans proline' 0 N--CA 1.461 -0.402 0 C-N-CA 121.583 1.522 . . . . 0.0 114.458 -177.843 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 25' ' ' VAL . . . . . . . . . . . . . 98.6 t -75.35 -45.7 39.93 Favored 'Isoleucine or valine' 0 C--O 1.235 0.327 0 N-CA-C 107.608 -1.256 . . . . 0.0 107.608 179.823 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -63.67 -40.81 97.77 Favored 'General case' 0 N--CA 1.451 -0.419 0 CA-C-O 119.207 -0.425 . . . . 0.0 110.398 179.22 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 27' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -62.43 -48.08 81.23 Favored 'General case' 0 CA--C 1.51 -0.564 0 C-N-CA 123.289 0.635 . . . . 0.0 111.494 -179.702 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 28' ' ' GLU . . . . . . . . . . . . . 29.3 tt0 -60.34 -49.28 78.22 Favored 'General case' 0 N--CA 1.449 -0.524 0 N-CA-C 108.679 -0.859 . . . . 0.0 108.679 179.15 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 49.6 m -58.23 -57.21 13.89 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 122.701 0.4 . . . . 0.0 110.131 -179.818 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 55.4 mt -56.5 -47.23 82.12 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.272 0 C-N-CA 124.08 0.952 . . . . 0.0 110.888 -179.253 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 23.3 ttt-85 -62.23 -44.57 96.27 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 118.378 -0.82 . . . . 0.0 111.367 -178.922 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 1.7 mptm? -61.9 -50.89 70.37 Favored 'General case' 0 C--O 1.226 -0.167 0 CA-C-N 118.618 0.644 . . . . 0.0 109.406 179.4 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 4.6 mptp? -62.53 -42.69 99.69 Favored 'General case' 0 N--CA 1.466 0.354 0 C-N-CA 123.193 0.597 . . . . 0.0 111.57 -179.023 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 34' ' ' ALA . . . . . . . . . . . . . . . -58.6 -53.06 62.59 Favored 'General case' 0 N--CA 1.451 -0.405 0 C-N-CA 123.645 0.778 . . . . 0.0 109.521 179.436 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 14.1 tt0 -62.35 -39.97 94.86 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-O 118.689 -0.672 . . . . 0.0 111.335 -178.037 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 36' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -60.59 -46.57 89.75 Favored 'General case' 0 CA--C 1.516 -0.34 0 C-N-CA 126.385 1.874 . . . . 0.0 108.33 179.099 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 37' ' ' SER . . . . . . . . . . . . . 6.3 t -73.22 -14.35 61.32 Favored 'General case' 0 N--CA 1.451 -0.399 0 C-N-CA 120.935 -0.306 . . . . 0.0 110.934 -179.686 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 81.92 2.97 90.71 Favored Glycine 0 CA--C 1.528 0.9 0 CA-C-O 118.713 -1.048 . . . . 0.0 111.71 -179.479 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 39' ' ' LEU . . . . . . . . . . . . . 64.0 mt -100.2 123.36 44.33 Favored 'General case' 0 N--CA 1.445 -0.698 0 C-N-CA 127.627 2.371 . . . . 0.0 106.269 -179.4 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 40' ' ' THR . . . . . . . . . . . . . 11.7 t -54.38 153.63 5.3 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 108.791 -0.818 . . . . 0.0 108.791 178.753 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 41' ' ' VAL . . . . . . . . . . . . . 56.1 t -47.6 -43.35 9.25 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.326 0 C-N-CA 124.768 1.227 . . . . 0.0 111.874 -179.21 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 42' ' ' SER . . . . . . . . . . . . . 2.1 p -61.26 -44.95 96.41 Favored 'General case' 0 CA--C 1.535 0.366 0 O-C-N 121.499 -0.751 . . . . 0.0 111.392 179.397 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -65.63 -44.29 86.89 Favored 'General case' 0 C--O 1.224 -0.271 0 C-N-CA 123.587 0.755 . . . . 0.0 108.98 178.692 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 44' ' ' TYR . . . . . . . . . . . . . 64.2 t80 -53.79 -50.5 65.95 Favored 'General case' 0 N--CA 1.454 -0.262 0 C-N-CA 124.654 1.182 . . . . 0.0 109.955 179.684 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 45' ' ' ILE . . . . . . . . . . . . . 10.0 mm -55.41 -62.48 0.79 Allowed 'Isoleucine or valine' 0 N--CA 1.463 0.196 0 C-N-CA 123.984 0.914 . . . . 0.0 111.41 179.853 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 46' ' ' ARG . . . . . . . . . . . . . 7.3 ptm180 -56.89 -40.64 76.61 Favored 'General case' 0 C--O 1.223 -0.342 0 CA-C-O 119.041 -0.504 . . . . 0.0 111.03 -179.045 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 47' ' ' ASN . . . . . . . . . . . . . 24.3 t30 -60.75 -55.38 33.89 Favored 'General case' 0 N--CA 1.449 -0.51 0 C-N-CA 123.677 0.791 . . . . 0.0 110.417 -179.583 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -61.46 -31.23 71.18 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 123.783 0.833 . . . . 0.0 112.382 -179.659 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 49' ' ' ALA . . . . . . . . . . . . . . . -75.27 -21.17 58.73 Favored 'General case' 0 N--CA 1.447 -0.595 0 N-CA-C 113.807 1.04 . . . . 0.0 113.807 -179.322 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 20.8 mt -101.12 -36.09 9.09 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-N 118.577 0.626 . . . . 0.0 110.468 -179.883 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 51' ' ' ASN . . . . . . . . . . . . . 58.0 m-80 . . . . . 0 C--O 1.246 0.898 0 CA-C-O 117.319 -1.324 . . . . 0.0 110.103 179.88 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 15.6 m . . . . . 0 N--CA 1.482 1.174 0 N-CA-C 107.074 -1.454 . . . . 0.0 107.074 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -85.87 172.84 10.42 Favored 'General case' 0 N--CA 1.439 -0.982 0 C-N-CA 131.641 3.976 . . . . 0.0 110.835 -176.682 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 27.2 m -163.26 178.52 8.11 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 125.759 1.624 . . . . 0.0 108.41 179.778 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -61.12 110.13 1.29 Allowed 'General case' 0 N--CA 1.451 -0.39 0 C-N-CA 123.413 0.685 . . . . 0.0 109.45 179.409 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 14.5 p -60.01 -18.73 16.27 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.647 0 C-N-CA 125.276 1.43 . . . . 0.0 112.35 179.45 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 8.9 ptp85 40.05 62.71 1.21 Allowed 'General case' 0 C--N 1.343 0.289 0 C-N-CA 127.683 2.393 . . . . 0.0 111.689 179.865 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 1.3 tmtp? -89.91 -23.23 21.66 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-O 118.012 -0.994 . . . . 0.0 112.786 -179.541 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 41.6 mttp -150.25 -69.07 0.19 Allowed 'General case' 0 N--CA 1.465 0.323 0 CA-C-N 119.715 1.143 . . . . 0.0 111.197 -179.635 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . 0.254 94.6 p 67.03 -11.31 0.27 Allowed 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 128.284 2.634 . . . . 0.0 113.487 -178.35 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 15.3 pt-20 -64.37 -4.07 3.51 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 126.826 2.05 . . . . 0.0 113.626 179.049 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 17.7 m -99.24 19.51 2.2 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.702 0 C-N-CA 127.756 2.423 . . . . 0.0 110.938 179.026 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 12.5 tpt180 -151.5 92.35 1.76 Allowed 'General case' 0 C--O 1.235 0.341 0 O-C-N 120.285 -1.509 . . . . 0.0 107.896 178.985 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 11.8 pt20 -72.53 94.15 1.66 Allowed 'General case' 0 N--CA 1.455 -0.201 0 N-CA-C 109.685 -0.487 . . . . 0.0 109.685 179.692 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -69.81 -24.29 63.46 Favored 'General case' 0 CA--C 1.532 0.259 0 O-C-N 121.959 -0.463 . . . . 0.0 111.154 179.132 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 3.4 t -80.05 -170.54 2.51 Favored 'General case' 0 N--CA 1.44 -0.925 0 CA-C-O 123.342 1.544 . . . . 0.0 109.153 179.173 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 3.1 t -142.08 143.37 26.67 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.881 0 N-CA-C 102.993 -2.966 . . . . 0.0 102.993 178.328 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 8.6 p -139.04 119.73 15.25 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.064 0 N-CA-C 106.409 -1.7 . . . . 0.0 106.409 178.77 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 52.6 ttm-85 -139.08 158.31 44.41 Favored 'General case' 0 CA--C 1.51 -0.568 0 CA-C-N 114.773 -1.103 . . . . 0.0 109.3 179.487 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 19.6 m -104.74 97.43 7.32 Favored 'General case' 0 N--CA 1.445 -0.68 0 N-CA-C 100.379 -3.934 . . . . 0.0 100.379 178.05 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 53.3 tp -109.9 92.29 3.99 Favored 'General case' 0 N--CA 1.448 -0.532 0 C-N-CA 125.964 1.706 . . . . 0.0 111.537 -178.038 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.414 ' HA ' ' O ' ' B' ' 16' ' ' VAL . 8.3 mpt_? -66.78 156.08 36.47 Favored 'General case' 0 N--CA 1.44 -0.966 0 C-N-CA 123.94 0.896 . . . . 0.0 110.151 177.054 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 62.7 m-85 -131.48 147.53 52.56 Favored 'General case' 0 N--CA 1.466 0.355 0 N-CA-C 104.125 -2.546 . . . . 0.0 104.125 177.25 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 1.1 m -76.83 169.52 20.74 Favored Pre-proline 0 CA--C 1.545 0.757 0 N-CA-C 109.07 -0.715 . . . . 0.0 109.07 -179.004 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 59.5 Cg_endo -67.17 -32.25 34.27 Favored 'Trans proline' 0 C--N 1.345 0.377 0 C-N-CA 121.946 1.764 . . . . 0.0 113.584 -178.562 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 55.9 t -74.29 -49.31 32.83 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.174 0 N-CA-C 107.471 -1.307 . . . . 0.0 107.471 179.228 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 2.4 mp0 -56.24 -46.07 79.74 Favored 'General case' 0 N--CA 1.449 -0.514 0 C-N-CA 124.825 1.25 . . . . 0.0 108.976 179.578 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -62.26 -48.05 81.64 Favored 'General case' 0 CA--C 1.512 -0.51 0 C-N-CA 123.874 0.87 . . . . 0.0 111.999 179.58 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 39.7 tt0 -59.2 -48.4 81.75 Favored 'General case' 0 N--CA 1.452 -0.35 0 N-CA-C 108.896 -0.779 . . . . 0.0 108.896 -179.888 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 51.9 m -59.04 -55.18 38.45 Favored 'General case' 0 N--CA 1.455 -0.206 0 C-N-CA 123.585 0.754 . . . . 0.0 109.213 179.377 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 90.3 mt -58.5 -41.53 82.02 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.245 0 C-N-CA 123.327 0.651 . . . . 0.0 110.366 -179.176 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 54.5 ttt180 -60.62 -49.9 75.69 Favored 'General case' 0 N--CA 1.462 0.15 0 CA-C-N 119.301 0.955 . . . . 0.0 108.981 179.038 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 5.2 mptp? -58.16 -53.02 62.99 Favored 'General case' 0 C--O 1.225 -0.206 0 N-CA-C 109.077 -0.712 . . . . 0.0 109.077 179.578 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -59.99 -43.19 95.31 Favored 'General case' 0 CA--C 1.517 -0.304 0 C-N-CA 123.342 0.657 . . . . 0.0 112.173 -178.64 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -63.76 -48.63 76.17 Favored 'General case' 0 N--CA 1.446 -0.635 0 C-N-CA 124.441 1.096 . . . . 0.0 110.244 -179.787 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 27.7 tt0 -67.06 -32.92 74.43 Favored 'General case' 0 CA--C 1.533 0.297 0 O-C-N 121.364 -0.835 . . . . 0.0 110.877 179.891 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 8.1 t70 -70.17 -44.79 68.03 Favored 'General case' 0 CA--C 1.514 -0.437 0 C-N-CA 124.334 1.054 . . . . 0.0 108.857 -178.986 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 22.7 t -75.63 -9.8 58.9 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 124.78 1.232 . . . . 0.0 110.324 178.678 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 74.14 -6.89 18.91 Favored Glycine 0 CA--C 1.532 1.153 0 CA-C-O 118.845 -0.975 . . . . 0.0 111.014 -178.632 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 44.1 mt -88.41 119.17 28.59 Favored 'General case' 0 CA--C 1.513 -0.479 0 CA-C-N 119.89 1.845 . . . . 0.0 107.316 -179.429 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 5.2 t -48.37 151.36 1.08 Allowed 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 124.396 1.078 . . . . 0.0 109.768 178.884 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 41.6 t -46.72 -45.26 7.27 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.315 0 C-N-CA 125.018 1.327 . . . . 0.0 111.447 -178.762 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 54.3 m -61.2 -47.45 86.07 Favored 'General case' 0 CA--C 1.539 0.55 0 O-C-N 121.453 -0.78 . . . . 0.0 111.644 179.705 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -64.96 -44.16 90.29 Favored 'General case' 0 C--O 1.223 -0.317 0 C-N-CA 123.828 0.851 . . . . 0.0 109.36 178.787 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 80.8 t80 -55.12 -51.27 66.96 Favored 'General case' 0 N--CA 1.45 -0.471 0 C-N-CA 124.899 1.28 . . . . 0.0 109.837 179.725 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 12.1 mm -55.56 -65.86 0.33 Allowed 'Isoleucine or valine' 0 C--N 1.339 0.132 0 C-N-CA 124.897 1.279 . . . . 0.0 110.416 179.734 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 11.5 ptt180 -55.6 -44.94 77.45 Favored 'General case' 0 C--O 1.22 -0.452 0 CA-C-O 117.894 -1.05 . . . . 0.0 111.843 -178.241 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 30.8 t30 -58.35 -52.1 67.03 Favored 'General case' 0 CA--C 1.529 0.148 0 CA-C-N 119.322 0.964 . . . . 0.0 110.133 179.653 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -61.29 -30.84 70.73 Favored 'General case' 0 CA--C 1.533 0.316 0 N-CA-C 112.246 0.462 . . . . 0.0 112.246 179.749 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -82.37 -32.2 29.37 Favored 'General case' 0 C--O 1.222 -0.355 0 N-CA-C 114.817 1.414 . . . . 0.0 114.817 -178.969 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 22.1 mt -81.8 -41.58 20.92 Favored 'General case' 0 CA--C 1.508 -0.667 0 N-CA-C 113.944 1.09 . . . . 0.0 113.944 -177.551 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 69.5 m-80 . . . . . 0 C--O 1.251 1.141 0 CA-C-O 117.661 -1.162 . . . . 0.0 109.054 -178.896 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' 1' ' ' SER . . . . . . . . . . . . . 15.9 m . . . . . 0 N--CA 1.481 1.122 0 N-CA-C 106.959 -1.497 . . . . 0.0 106.959 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' 2' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -86.34 171.48 11.16 Favored 'General case' 0 N--CA 1.439 -1.003 1 C-N-CA 131.894 4.078 . . . . 0.0 109.953 -176.758 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 3' ' ' SER . . . . . . . . . . . . . 37.0 m -160.87 175.3 12.69 Favored 'General case' 0 C--O 1.234 0.271 0 C-N-CA 124.904 1.282 . . . . 0.0 108.872 179.87 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 4' ' ' ALA . . . . . . . . . . . . . . . -62.3 107.34 0.89 Allowed 'General case' 0 N--CA 1.452 -0.372 0 C-N-CA 124.075 0.95 . . . . 0.0 108.922 179.418 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 25.5 t -63.62 -26.15 40.02 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.473 0 C-N-CA 124.465 1.106 . . . . 0.0 111.697 -179.516 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 6' ' ' ARG . . . . . . . . . . . . . 85.3 mtt85 52.15 32.31 10.36 Favored 'General case' 0 N--CA 1.471 0.621 0 CA-C-N 119.705 1.138 . . . . 0.0 112.375 179.846 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 2.9 tmtt? -43.45 -23.65 0.07 Allowed 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 127.504 2.322 . . . . 0.0 115.571 -178.685 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 9.0 ptpp? -157.6 -35.88 0.07 Allowed 'General case' 0 C--N 1.332 -0.19 0 C-N-CA 125.111 1.364 . . . . 0.0 110.181 178.191 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 68.6 m 59.45 -21.33 0.03 OUTLIER 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 128.422 2.689 . . . . 0.0 116.735 179.547 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 10' ' ' GLU . . . . . . . . . . . . . 19.4 pt-20 -61.12 -18.16 56.56 Favored 'General case' 0 C--N 1.33 -0.263 0 C-N-CA 128.508 2.723 . . . . 0.0 115.619 -179.368 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 11' ' ' VAL . . . . . . . . . . . . . 16.0 m -70.73 -6.22 6.79 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.731 0 C-N-CA 127.857 2.463 . . . . 0.0 114.536 -178.906 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 12' ' ' ARG . . . . . . . . . . . . . 57.6 ttt85 -141.09 116.22 9.92 Favored 'General case' 0 C--O 1.236 0.344 0 CA-C-N 119.854 1.206 . . . . 0.0 108.744 179.26 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 13' ' ' GLN . . . . . . . . . . . . . 8.8 pt20 -78.89 96.91 5.81 Favored 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 123.414 0.685 . . . . 0.0 110.395 179.161 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -78.35 -38.31 42.32 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 106.517 -1.66 . . . . 0.0 106.517 177.557 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 1.3 t -73.53 164.94 25.97 Favored 'General case' 0 N--CA 1.444 -0.726 0 CA-C-O 122.032 0.92 . . . . 0.0 108.83 177.669 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 16' ' ' VAL . . . . . 0.414 ' O ' ' HA ' ' A' ' 21' ' ' ARG . 19.4 t -114.39 142.75 25.97 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.573 0 N-CA-C 105.771 -1.937 . . . . 0.0 105.771 179.325 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 12.4 p -135.8 108.93 9.17 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 N-CA-C 106.188 -1.782 . . . . 0.0 106.188 178.675 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 43.4 ttm-85 -134.38 150.04 50.87 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-N 115.855 -0.612 . . . . 0.0 110.1 -179.745 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 22.5 m -88.57 75.45 8.32 Favored 'General case' 0 N--CA 1.45 -0.459 0 C-N-CA 125.264 1.426 . . . . 0.0 108.265 179.801 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 16.6 tp -86.44 136.99 32.9 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 105.947 -1.872 . . . . 0.0 105.947 178.818 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 78.9 mtt180 -132.62 166.75 21.42 Favored 'General case' 0 N--CA 1.451 -0.42 0 C-N-CA 127.182 2.193 . . . . 0.0 110.094 -179.078 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 22' ' ' PHE . . . . . . . . . . . . . 87.6 m-85 -136.76 -178.04 5.01 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 124.611 1.164 . . . . 0.0 110.114 -179.721 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -105.83 173.48 3.2 Favored Pre-proline 0 CA--C 1.542 0.663 0 C-N-CA 124.181 0.992 . . . . 0.0 109.751 179.758 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 24' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -68.32 -37.83 12.99 Favored 'Trans proline' 0 C--N 1.347 0.471 0 C-N-CA 121.55 1.5 . . . . 0.0 114.371 -177.494 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 25' ' ' VAL . . . . . . . . . . . . . 81.6 t -74.97 -41.6 45.93 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.202 0 N-CA-C 108.793 -0.818 . . . . 0.0 108.793 179.489 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -60.39 -51.71 68.32 Favored 'General case' 0 N--CA 1.45 -0.469 0 C-N-CA 126.559 1.944 . . . . 0.0 109.941 -178.776 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 27' ' ' ASP . . . . . . . . . . . . . 16.8 t70 -61.11 -49.85 75.64 Favored 'General case' 0 CA--C 1.512 -0.515 0 C-N-CA 124.732 1.213 . . . . 0.0 110.676 179.601 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 28' ' ' GLU . . . . . . . . . . . . . 31.1 tt0 -58.85 -45.23 90.58 Favored 'General case' 0 N--CA 1.447 -0.601 0 N-CA-C 109.106 -0.701 . . . . 0.0 109.106 -179.757 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 99.1 m -59.97 -55.93 27.93 Favored 'General case' 0 CA--C 1.53 0.199 0 CA-C-N 118.677 0.671 . . . . 0.0 109.288 179.062 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 65.6 mt -55.6 -42.93 71.0 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.215 0 C-N-CA 123.012 0.525 . . . . 0.0 109.912 -179.76 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 77.3 ttt180 -64.41 -44.6 90.73 Favored 'General case' 0 N--CA 1.45 -0.442 0 CA-C-O 118.336 -0.84 . . . . 0.0 111.246 -179.185 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 1.6 mptp? -62.69 -47.19 84.73 Favored 'General case' 0 C--O 1.222 -0.363 0 CA-C-O 118.101 -0.952 . . . . 0.0 109.062 179.579 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 1.5 mptm? -61.83 -47.82 83.37 Favored 'General case' 0 CA--C 1.518 -0.272 0 CA-C-N 119.48 1.036 . . . . 0.0 110.369 -179.736 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 34' ' ' ALA . . . . . . . . . . . . . . . -54.63 -57.86 9.79 Favored 'General case' 0 N--CA 1.448 -0.554 0 C-N-CA 124.94 1.296 . . . . 0.0 109.866 179.456 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 41.3 tt0 -61.81 -41.59 97.95 Favored 'General case' 0 N--CA 1.464 0.273 0 C-N-CA 124.649 1.18 . . . . 0.0 112.271 -178.946 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 36' ' ' ASP . . . . . . . . . . . . . 4.8 t70 -61.02 -42.32 98.24 Favored 'General case' 0 C--N 1.332 -0.184 0 C-N-CA 124.613 1.165 . . . . 0.0 108.393 179.617 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 37' ' ' SER . . . . . . . . . . . . . 29.5 t -77.68 -7.82 57.01 Favored 'General case' 0 N--CA 1.445 -0.684 0 C-N-CA 124.598 1.159 . . . . 0.0 110.839 179.107 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 77.13 15.05 81.97 Favored Glycine 0 CA--C 1.523 0.563 0 CA-C-O 117.061 -1.966 . . . . 0.0 115.998 178.895 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 39' ' ' LEU . . . . . . . . . . . . . 8.3 mt -120.68 143.37 48.76 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-N 120.892 2.346 . . . . 0.0 106.214 179.542 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 40' ' ' THR . . . . . . . . . . . . . 10.1 t -63.85 152.16 40.42 Favored 'General case' 0 C--N 1.321 -0.671 0 O-C-N 120.964 -1.085 . . . . 0.0 108.393 178.939 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 41' ' ' VAL . . . . . . . . . . . . . 52.6 t -48.07 -42.02 10.27 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.254 0 C-N-CA 125.267 1.427 . . . . 0.0 111.452 179.319 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 42' ' ' SER . . . . . . . . . . . . . 70.7 m -57.94 -43.09 86.14 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-N 120.301 1.409 . . . . 0.0 111.716 179.923 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -65.11 -51.04 63.63 Favored 'General case' 0 N--CA 1.452 -0.345 0 N-CA-C 107.529 -1.286 . . . . 0.0 107.529 178.087 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 44' ' ' TYR . . . . . . . . . . . . . 69.5 t80 -53.98 -45.71 71.49 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 123.548 0.739 . . . . 0.0 111.362 -179.647 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 45' ' ' ILE . . . . . . . . . . . . . 16.0 mm -59.47 -68.43 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.34 0.184 0 C-N-CA 125.352 1.461 . . . . 0.0 109.904 179.718 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 46' ' ' ARG . . . . . . . . . . . . . 17.8 ptt85 -51.65 -44.92 63.18 Favored 'General case' 0 C--O 1.219 -0.538 0 CA-C-O 118.971 -0.538 . . . . 0.0 110.537 -178.373 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 47' ' ' ASN . . . . . . . . . . . . . 32.4 t30 -62.43 -47.78 82.56 Favored 'General case' 0 N--CA 1.444 -0.758 0 CA-C-O 117.639 -1.172 . . . . 0.0 112.47 -179.008 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -64.41 -29.14 70.2 Favored 'General case' 0 CA--C 1.531 0.237 0 CA-C-N 119.115 0.87 . . . . 0.0 110.514 179.544 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 49' ' ' ALA . . . . . . . . . . . . . . . -73.75 -21.28 60.25 Favored 'General case' 0 CA--C 1.539 0.522 0 N-CA-C 112.494 0.554 . . . . 0.0 112.494 179.575 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 6.3 mt -101.33 -33.79 9.88 Favored 'General case' 0 N--CA 1.463 0.223 0 C-N-CA 124.532 1.133 . . . . 0.0 109.783 -179.085 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 51' ' ' ASN . . . . . . . . . . . . . 69.4 m-80 . . . . . 0 C--O 1.253 1.263 0 C-N-CA 125.671 1.589 . . . . 0.0 109.11 178.984 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 13.0 m . . . . . 0 N--CA 1.483 1.186 0 CA-C-O 122.873 1.32 . . . . 0.0 108.402 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -80.87 -17.96 48.93 Favored 'General case' 0 C--N 1.321 -0.655 1 C-N-CA 133.501 4.72 . . . . 0.0 111.974 -177.108 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 6.1 t -176.8 172.22 2.1 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 129.74 3.216 . . . . 0.0 105.104 179.378 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -143.13 168.83 18.81 Favored 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 124.657 1.183 . . . . 0.0 108.956 178.656 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 28.8 m -93.72 -178.56 0.44 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.489 0 C-N-CA 124.409 1.084 . . . . 0.0 111.004 -179.4 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -134.8 132.53 38.8 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 124.485 1.114 . . . . 0.0 110.384 -179.21 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 26.5 mtpp -120.55 118.47 30.28 Favored 'General case' 0 C--O 1.233 0.215 0 N-CA-C 106.498 -1.667 . . . . 0.0 106.498 178.824 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 9.4 mtmp? -71.78 159.64 33.99 Favored 'General case' 0 CA--C 1.521 -0.163 0 C-N-CA 123.636 0.774 . . . . 0.0 112.435 -178.684 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 7.4 p -78.42 -27.78 46.64 Favored 'General case' 0 N--CA 1.447 -0.577 0 C-N-CA 125.201 1.4 . . . . 0.0 112.262 179.355 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 28.4 mm-40 -138.43 158.47 44.21 Favored 'General case' 0 C--O 1.239 0.523 0 C-N-CA 125.955 1.702 . . . . 0.0 111.488 -179.094 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 2.2 p -133.58 -42.78 0.53 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.31 0 C-N-CA 126.507 1.923 . . . . 0.0 110.381 179.596 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 50.1 ttt85 -61.54 -56.49 19.44 Favored 'General case' 0 C--O 1.231 0.122 0 C-N-CA 125.134 1.373 . . . . 0.0 111.244 -179.386 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 38.7 mt-30 -124.35 91.71 3.51 Favored 'General case' 0 CA--C 1.52 -0.178 0 N-CA-C 108.464 -0.939 . . . . 0.0 108.464 179.347 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 13.4 ptmm? -68.04 -32.44 72.81 Favored 'General case' 0 C--O 1.223 -0.326 0 N-CA-C 109.841 -0.429 . . . . 0.0 109.841 178.686 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 3.9 t -86.8 161.53 18.3 Favored 'General case' 0 N--CA 1.447 -0.587 0 N-CA-C 108.605 -0.887 . . . . 0.0 108.605 179.245 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 4.1 t -109.0 138.77 34.58 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.635 0 N-CA-C 103.65 -2.722 . . . . 0.0 103.65 178.164 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 11.5 p -140.73 117.26 7.9 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.388 0 N-CA-C 106.639 -1.615 . . . . 0.0 106.639 178.89 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 33.3 ttt180 -150.19 173.31 14.07 Favored 'General case' 0 C--O 1.236 0.375 0 N-CA-C 107.835 -1.172 . . . . 0.0 107.835 -179.782 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 27.1 m -111.46 120.35 41.87 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 104.895 -2.261 . . . . 0.0 104.895 179.078 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -120.62 104.68 10.12 Favored 'General case' 0 N--CA 1.449 -0.511 0 N-CA-C 106.32 -1.733 . . . . 0.0 106.32 179.484 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 26.3 mtm-85 -84.98 157.16 20.86 Favored 'General case' 0 N--CA 1.448 -0.543 0 N-CA-C 109.662 -0.495 . . . . 0.0 109.662 178.874 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 97.5 m-85 -137.66 163.42 31.3 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 108.321 -0.992 . . . . 0.0 108.321 179.936 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 19.3 m -91.98 168.3 13.32 Favored Pre-proline 0 CA--C 1.547 0.834 0 CA-C-O 118.154 -0.927 . . . . 0.0 108.53 179.734 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 45.8 Cg_endo -63.14 -41.97 25.41 Favored 'Trans proline' 0 C--N 1.348 0.529 0 C-N-CA 121.72 1.613 . . . . 0.0 113.03 -177.499 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 65.6 t -68.2 -26.61 34.52 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.363 0 C-N-CA 123.963 0.905 . . . . 0.0 110.561 -179.654 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 4.2 mm-40 -81.65 -38.12 26.42 Favored 'General case' 0 C--N 1.333 -0.124 0 C-N-CA 124.083 0.953 . . . . 0.0 109.572 -179.297 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -69.04 -44.08 73.38 Favored 'General case' 0 C--O 1.221 -0.416 0 C-N-CA 125.429 1.492 . . . . 0.0 108.636 178.626 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 24.6 tt0 -54.22 -52.32 61.64 Favored 'General case' 0 N--CA 1.451 -0.382 0 C-N-CA 126.615 1.966 . . . . 0.0 109.455 179.064 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 72.8 m -65.79 -52.01 54.31 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-O 118.969 -0.538 . . . . 0.0 110.915 -179.4 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 71.1 mt -58.53 -41.75 82.71 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.261 0 CA-C-N 118.191 0.451 . . . . 0.0 110.611 -178.694 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 50.7 ttt85 -64.94 -48.66 73.32 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-O 118.868 -0.586 . . . . 0.0 110.352 -179.516 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 11.7 mptt -63.87 -46.88 82.97 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-O 118.737 -0.649 . . . . 0.0 111.002 -179.243 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.8 -43.38 98.95 Favored 'General case' 0 C--O 1.228 -0.041 0 CA-C-N 118.63 0.65 . . . . 0.0 110.218 -179.508 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -59.16 -52.74 64.42 Favored 'General case' 0 N--CA 1.454 -0.25 0 C-N-CA 123.842 0.857 . . . . 0.0 110.128 179.455 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 18.0 tt0 -59.39 -39.25 82.74 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 123.392 0.677 . . . . 0.0 111.784 -178.896 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -71.3 -40.91 70.56 Favored 'General case' 0 N--CA 1.463 0.196 0 CA-C-N 118.416 0.553 . . . . 0.0 109.913 178.841 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 23.1 t -69.38 -9.04 51.72 Favored 'General case' 0 N--CA 1.448 -0.542 0 C-N-CA 123.606 0.762 . . . . 0.0 110.66 179.788 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 67.42 20.74 71.88 Favored Glycine 0 CA--C 1.527 0.83 0 CA-C-N 119.061 0.846 . . . . 0.0 111.064 -179.203 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 70.6 mt -117.71 116.79 27.74 Favored 'General case' 0 CA--C 1.513 -0.474 0 N-CA-C 104.148 -2.538 . . . . 0.0 104.148 179.791 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 5.2 t -54.24 152.2 6.48 Favored 'General case' 0 CA--C 1.539 0.533 0 N-CA-C 108.551 -0.907 . . . . 0.0 108.551 179.171 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 53.1 t -45.71 -43.25 4.08 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.224 0 C-N-CA 124.02 0.928 . . . . 0.0 111.629 -179.479 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 8.9 p -59.35 -47.03 86.94 Favored 'General case' 0 CA--C 1.536 0.42 0 O-C-N 121.58 -0.7 . . . . 0.0 111.614 -179.954 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -67.01 -43.25 83.36 Favored 'General case' 0 N--CA 1.454 -0.226 0 C-N-CA 124.454 1.102 . . . . 0.0 109.967 178.992 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 36.2 t80 -53.74 -51.38 63.54 Favored 'General case' 0 N--CA 1.453 -0.319 0 C-N-CA 125.265 1.426 . . . . 0.0 109.137 179.684 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 8.3 mm -53.82 -63.21 0.55 Allowed 'Isoleucine or valine' 0 CA--C 1.529 0.14 0 C-N-CA 124.668 1.187 . . . . 0.0 110.093 179.733 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 6.9 ptm180 -56.83 -44.99 82.6 Favored 'General case' 0 C--O 1.224 -0.28 0 CA-C-O 118.296 -0.859 . . . . 0.0 112.718 -178.744 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 25.5 t30 -59.55 -53.07 62.38 Favored 'General case' 0 C--O 1.232 0.143 0 C-N-CA 124.449 1.1 . . . . 0.0 110.468 -179.912 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -62.67 -33.09 74.36 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 123.316 0.646 . . . . 0.0 111.324 179.834 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -75.26 -15.34 60.53 Favored 'General case' 0 CA--C 1.536 0.421 0 N-CA-C 114.128 1.158 . . . . 0.0 114.128 -179.673 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 17.6 mt -107.05 -34.77 7.07 Favored 'General case' 0 CA--C 1.517 -0.297 0 CA-C-N 119.426 1.012 . . . . 0.0 112.418 -179.889 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 56.2 m-80 . . . . . 0 C--O 1.247 0.968 0 C-N-CA 123.654 0.782 . . . . 0.0 111.595 -178.981 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 1' ' ' SER . . . . . . . . . . . . . 12.3 m . . . . . 0 N--CA 1.483 1.211 0 CA-C-O 122.85 1.309 . . . . 0.0 108.494 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 2' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -77.15 -32.21 56.15 Favored 'General case' 0 C--N 1.319 -0.747 1 C-N-CA 133.344 4.657 . . . . 0.0 111.383 -177.247 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 3' ' ' SER . . . . . . . . . . . . . 5.1 t -159.53 179.26 9.07 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 126.93 2.092 . . . . 0.0 106.463 179.134 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 4' ' ' ALA . . . . . . . . . . . . . . . -140.36 -176.78 4.75 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 124.931 1.292 . . . . 0.0 110.853 -179.535 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 16.7 m -129.08 158.16 41.79 Favored 'Isoleucine or valine' 0 C--O 1.239 0.537 0 C-N-CA 126.053 1.741 . . . . 0.0 108.449 179.435 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 6' ' ' ARG . . . . . . . . . . . . . 25.4 mmt180 -120.36 163.0 18.52 Favored 'General case' 0 N--CA 1.464 0.274 0 C-N-CA 123.578 0.751 . . . . 0.0 110.118 -179.576 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 20.8 mttp -142.4 132.44 24.51 Favored 'General case' 0 C--N 1.331 -0.199 0 C-N-CA 126.205 1.802 . . . . 0.0 106.268 179.496 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 7.1 mtmp? -71.51 163.06 28.44 Favored 'General case' 0 C--O 1.236 0.38 0 CA-C-N 118.292 0.496 . . . . 0.0 110.408 -179.729 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 5.3 p -71.25 -76.94 0.1 Allowed 'General case' 0 N--CA 1.45 -0.459 0 C-N-CA 124.881 1.273 . . . . 0.0 109.111 179.332 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 10' ' ' GLU . . . . . . . . . . . . . 51.4 mm-40 -76.24 168.66 19.65 Favored 'General case' 0 C--O 1.236 0.374 0 C-N-CA 124.579 1.152 . . . . 0.0 112.141 -179.391 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 11' ' ' VAL . . . . . . . . . . . . . 33.9 m -132.24 -50.88 0.76 Allowed 'Isoleucine or valine' 0 C--O 1.236 0.392 0 C-N-CA 125.629 1.571 . . . . 0.0 110.396 179.245 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 12' ' ' ARG . . . . . . . . . . . . . 28.8 ttt85 -65.63 -52.65 50.3 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-N 119.132 0.878 . . . . 0.0 111.474 -178.269 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 13' ' ' GLN . . . . . . . . . . . . . 47.4 mt-30 -135.17 99.65 4.32 Favored 'General case' 0 CA--C 1.517 -0.294 0 C-N-CA 123.941 0.896 . . . . 0.0 108.677 178.91 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 10.4 ptmm? -62.31 -33.74 75.26 Favored 'General case' 0 C--O 1.225 -0.226 0 CA-C-N 115.638 -0.71 . . . . 0.0 109.881 178.356 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 4.1 t -89.21 157.24 18.32 Favored 'General case' 0 N--CA 1.439 -0.985 0 C-N-CA 124.327 1.051 . . . . 0.0 110.548 -179.618 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 36.0 t -101.51 152.42 5.27 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 N-CA-C 105.409 -2.071 . . . . 0.0 105.409 178.422 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 11.1 p -147.66 110.82 0.72 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 N-CA-C 103.501 -2.777 . . . . 0.0 103.501 178.121 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 32.2 ttt180 -145.0 158.71 43.73 Favored 'General case' 0 C--O 1.233 0.197 0 O-C-N 121.274 -0.891 . . . . 0.0 113.299 -178.425 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 3.9 m -92.23 80.18 5.03 Favored 'General case' 0 N--CA 1.451 -0.377 0 C-N-CA 125.998 1.719 . . . . 0.0 107.812 -179.361 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -85.62 93.02 8.72 Favored 'General case' 0 C--N 1.326 -0.439 0 O-C-N 121.32 -0.863 . . . . 0.0 109.102 -179.453 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 14.5 mmm-85 -78.44 154.2 30.82 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 122.987 0.515 . . . . 0.0 110.179 179.101 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 22' ' ' PHE . . . . . . . . . . . . . 92.0 m-85 -141.35 174.18 10.78 Favored 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 125.506 1.522 . . . . 0.0 108.269 179.139 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 23' ' ' SER . . . . . 0.448 ' HB3' ' HD2' ' B' ' 24' ' ' PRO . 3.2 m -104.25 176.66 1.67 Allowed Pre-proline 0 CA--C 1.544 0.716 0 CA-C-O 117.809 -1.091 . . . . 0.0 110.124 179.562 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 24' ' ' PRO . . . . . 0.448 ' HD2' ' HB3' ' B' ' 23' ' ' SER . 85.7 Cg_endo -77.17 -29.0 5.35 Favored 'Trans proline' 0 C--N 1.35 0.62 0 CA-C-N 121.519 1.578 . . . . 0.0 112.634 -178.107 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 25' ' ' VAL . . . . . . . . . . . . . 11.4 t -75.66 -34.66 29.34 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.177 0 N-CA-C 107.295 -1.372 . . . . 0.0 107.295 179.237 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -69.08 -45.63 69.8 Favored 'General case' 0 N--CA 1.447 -0.595 0 N-CA-C 107.48 -1.304 . . . . 0.0 107.48 178.41 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 27' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -60.7 -49.3 78.05 Favored 'General case' 0 C--O 1.218 -0.601 0 N-CA-C 109.194 -0.669 . . . . 0.0 109.194 179.097 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 28' ' ' GLU . . . . . . . . . . . . . 36.4 tt0 -61.32 -23.03 65.43 Favored 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 123.965 0.906 . . . . 0.0 111.48 -179.806 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 88.6 m -85.21 -53.92 4.94 Favored 'General case' 0 N--CA 1.452 -0.35 0 N-CA-C 108.035 -1.098 . . . . 0.0 108.035 178.616 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 58.8 mt -58.43 -46.16 89.57 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.507 0 C-N-CA 124.591 1.156 . . . . 0.0 110.18 -179.278 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 54.0 ttt85 -59.98 -52.33 65.87 Favored 'General case' 0 N--CA 1.451 -0.387 0 C-N-CA 124.299 1.04 . . . . 0.0 110.142 -179.456 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 5.9 mptt -59.42 -48.44 81.65 Favored 'General case' 0 N--CA 1.456 -0.164 0 O-C-N 123.711 0.632 . . . . 0.0 110.499 -179.073 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -67.02 -38.46 86.0 Favored 'General case' 0 C--O 1.226 -0.158 0 CA-C-N 118.123 0.42 . . . . 0.0 112.085 -178.586 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 34' ' ' ALA . . . . . . . . . . . . . . . -59.94 -52.81 63.82 Favored 'General case' 0 N--CA 1.452 -0.371 0 C-N-CA 124.015 0.926 . . . . 0.0 108.79 179.034 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 5.9 tt0 -65.73 -30.84 71.57 Favored 'General case' 0 CA--C 1.534 0.348 0 O-C-N 122.217 -0.302 . . . . 0.0 110.755 -178.962 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 36' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -67.32 -42.29 83.86 Favored 'General case' 0 N--CA 1.462 0.147 0 C-N-CA 124.264 1.026 . . . . 0.0 108.242 178.697 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 37' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -74.51 -21.57 59.48 Favored 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 124.356 1.063 . . . . 0.0 110.675 178.781 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 85.56 -5.93 81.91 Favored Glycine 0 CA--C 1.537 1.428 0 N-CA-C 109.71 -1.356 . . . . 0.0 109.71 -177.688 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 39' ' ' LEU . . . . . . . . . . . . . 84.4 mt -89.01 110.27 20.99 Favored 'General case' 0 N--CA 1.445 -0.687 0 C-N-CA 128.144 2.578 . . . . 0.0 105.68 179.312 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 40' ' ' THR . . . . . . . . . . . . . 5.0 t -48.04 155.2 0.47 Allowed 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 123.777 0.831 . . . . 0.0 109.589 178.184 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 41' ' ' VAL . . . . . . . . . . . . . 52.9 t -45.65 -43.2 3.95 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.505 0 C-N-CA 124.479 1.112 . . . . 0.0 111.441 -179.392 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 42' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -64.26 -35.64 81.49 Favored 'General case' 0 CA--C 1.542 0.638 0 O-C-N 121.487 -0.758 . . . . 0.0 112.93 179.823 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -76.25 -44.51 37.09 Favored 'General case' 0 C--O 1.226 -0.162 0 C-N-CA 126.277 1.831 . . . . 0.0 108.957 178.579 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 44' ' ' TYR . . . . . . . . . . . . . 64.0 t80 -55.69 -51.93 65.59 Favored 'General case' 0 N--CA 1.446 -0.659 0 C-N-CA 124.812 1.245 . . . . 0.0 109.256 179.5 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 45' ' ' ILE . . . . . . . . . . . . . 21.6 mm -54.96 -60.43 1.6 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.395 0 C-N-CA 123.86 0.864 . . . . 0.0 111.739 179.653 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 46' ' ' ARG . . . . . . . . . . . . . 3.3 ptm180 -53.91 -45.58 71.21 Favored 'General case' 0 C--O 1.224 -0.246 0 CA-C-O 118.429 -0.796 . . . . 0.0 111.368 -179.508 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 47' ' ' ASN . . . . . . . . . . . . . 27.4 t30 -62.24 -57.02 12.96 Favored 'General case' 0 N--CA 1.452 -0.343 0 C-N-CA 124.939 1.296 . . . . 0.0 110.878 -179.473 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -58.13 -30.58 66.44 Favored 'General case' 0 C--N 1.334 -0.093 0 C-N-CA 123.891 0.876 . . . . 0.0 113.264 -178.725 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 49' ' ' ALA . . . . . . . . . . . . . . . -82.58 -29.35 30.31 Favored 'General case' 0 N--CA 1.451 -0.41 0 N-CA-C 114.274 1.213 . . . . 0.0 114.274 -179.208 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 43.7 mt -84.88 -37.6 20.43 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-N 119.084 0.856 . . . . 0.0 111.171 -179.234 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 51' ' ' ASN . . . . . . . . . . . . . 63.5 m-20 . . . . . 0 C--O 1.251 1.149 0 CA-C-O 116.576 -1.678 . . . . 0.0 110.324 179.33 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 10.8 m . . . . . 0 CA--C 1.512 -0.506 0 N-CA-C 107.163 -1.421 . . . . 0.0 107.163 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -58.61 -50.82 72.41 Favored 'General case' 0 C--N 1.323 -0.559 0 C-N-CA 128.21 2.604 . . . . 0.0 109.924 -178.988 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 9.8 p -163.21 -84.05 0.03 OUTLIER 'General case' 0 N--CA 1.454 -0.265 0 N-CA-C 107.936 -1.135 . . . . 0.0 107.936 178.904 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -143.09 177.07 8.63 Favored 'General case' 0 CA--C 1.53 0.189 0 C-N-CA 125.776 1.63 . . . . 0.0 109.11 179.744 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 8.6 p -143.68 170.34 9.61 Favored 'Isoleucine or valine' 0 C--O 1.238 0.495 0 N-CA-C 108.242 -1.022 . . . . 0.0 108.242 179.814 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 4.3 ptp180 -141.35 162.26 35.9 Favored 'General case' 0 C--N 1.333 -0.145 0 C-N-CA 125.399 1.48 . . . . 0.0 108.564 179.347 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 12.2 pttp -167.89 174.47 7.45 Favored 'General case' 0 C--N 1.328 -0.329 0 C-N-CA 126.086 1.754 . . . . 0.0 107.098 179.485 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 35.4 mtpt -62.33 131.3 48.87 Favored 'General case' 0 CA--C 1.535 0.373 0 N-CA-C 103.511 -2.774 . . . . 0.0 103.511 175.905 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -119.17 -67.94 0.95 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 119.845 1.202 . . . . 0.0 107.921 179.684 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 21.1 mt-10 -143.31 172.11 13.21 Favored 'General case' 0 C--O 1.239 0.53 0 C-N-CA 125.802 1.641 . . . . 0.0 108.286 179.605 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -162.64 134.38 0.96 Allowed 'Isoleucine or valine' 0 C--O 1.239 0.533 0 C-N-CA 125.22 1.408 . . . . 0.0 107.23 178.338 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 6.7 ttm180 -166.44 -172.89 2.33 Favored 'General case' 0 C--O 1.241 0.658 0 N-CA-C 105.805 -1.924 . . . . 0.0 105.805 178.932 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 8.8 mp0 -82.0 76.04 8.91 Favored 'General case' 0 N--CA 1.453 -0.294 0 N-CA-C 108.44 -0.948 . . . . 0.0 108.44 179.752 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 44.6 pttt -64.18 -33.46 75.84 Favored 'General case' 0 C--O 1.221 -0.414 0 C-N-CA 123.833 0.853 . . . . 0.0 109.906 178.476 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 4.1 t -81.06 165.09 21.97 Favored 'General case' 0 N--CA 1.437 -1.097 0 CA-C-O 122.161 0.981 . . . . 0.0 108.355 178.902 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 24.7 t -109.71 147.03 14.39 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.763 0 N-CA-C 104.437 -2.431 . . . . 0.0 104.437 176.665 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 11.3 p -143.44 105.45 1.01 Allowed 'Isoleucine or valine' 0 N--CA 1.445 -0.709 0 N-CA-C 104.431 -2.433 . . . . 0.0 104.431 178.198 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 49.5 ttm-85 -148.34 156.02 42.0 Favored 'General case' 0 C--N 1.325 -0.462 0 C-N-CA 123.245 0.618 . . . . 0.0 109.743 -179.344 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 23.4 m -103.62 129.7 50.94 Favored 'General case' 0 N--CA 1.451 -0.402 0 N-CA-C 104.07 -2.567 . . . . 0.0 104.07 178.445 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -135.98 111.66 9.36 Favored 'General case' 0 N--CA 1.453 -0.322 0 N-CA-C 108.163 -1.051 . . . . 0.0 108.163 -178.413 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 89.4 mtm-85 -86.06 138.93 31.58 Favored 'General case' 0 N--CA 1.462 0.168 0 CA-C-O 117.369 -1.3 . . . . 0.0 112.345 -178.805 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 32.2 m-85 -123.0 159.39 28.47 Favored 'General case' 0 N--CA 1.481 1.112 0 C-N-CA 127.12 2.168 . . . . 0.0 110.195 -178.62 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 23' ' ' SER . . . . . 0.401 ' HB3' ' HD2' ' A' ' 24' ' ' PRO . 1.9 m -80.75 167.72 30.48 Favored Pre-proline 0 CA--C 1.541 0.614 0 CA-C-N 119.097 0.862 . . . . 0.0 109.691 179.7 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 24' ' ' PRO . . . . . 0.401 ' HD2' ' HB3' ' A' ' 23' ' ' SER . 41.8 Cg_endo -65.25 -42.17 14.19 Favored 'Trans proline' 0 N--CA 1.459 -0.535 0 C-N-CA 121.929 1.752 . . . . 0.0 112.373 -179.653 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 77.1 t -58.39 -53.07 51.47 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.315 0 N-CA-C 108.075 -1.083 . . . . 0.0 108.075 179.757 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 -56.84 -46.03 81.98 Favored 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 124.451 1.1 . . . . 0.0 110.863 179.453 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 19.3 t70 -60.24 -50.1 75.01 Favored 'General case' 0 CA--C 1.512 -0.511 0 C-N-CA 124.072 0.949 . . . . 0.0 112.549 -179.618 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -60.24 -43.61 95.93 Favored 'General case' 0 N--CA 1.452 -0.338 0 N-CA-C 109.645 -0.502 . . . . 0.0 109.645 -179.783 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 63.1 m -58.71 -54.42 47.29 Favored 'General case' 0 N--CA 1.451 -0.385 0 N-CA-C 109.293 -0.632 . . . . 0.0 109.293 179.448 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 78.3 mt -58.14 -45.58 88.56 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.362 0 C-N-CA 123.008 0.523 . . . . 0.0 109.727 -179.673 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 29.1 ttt180 -61.65 -43.61 98.53 Favored 'General case' 0 C--N 1.334 -0.076 0 O-C-N 121.358 -0.839 . . . . 0.0 112.225 -178.941 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -68.81 -47.69 65.46 Favored 'General case' 0 CA--C 1.528 0.127 0 CA-C-N 118.915 0.78 . . . . 0.0 109.922 -179.7 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 71.8 mmtt -63.93 -46.42 84.82 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-N 118.819 0.736 . . . . 0.0 112.098 -178.885 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -60.01 -52.48 65.19 Favored 'General case' 0 N--CA 1.448 -0.549 0 C-N-CA 122.53 0.332 . . . . 0.0 110.614 -179.482 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 26.9 tp10 -62.8 -37.35 86.37 Favored 'General case' 0 N--CA 1.454 -0.263 0 CA-C-N 116.594 -0.276 . . . . 0.0 111.4 -178.646 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -63.79 -38.89 92.79 Favored 'General case' 0 CA--C 1.527 0.059 0 N-CA-C 108.685 -0.857 . . . . 0.0 108.685 179.282 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 33.1 t -75.19 -10.45 59.48 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 123.76 0.824 . . . . 0.0 110.725 178.69 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 77.77 4.02 84.7 Favored Glycine 0 CA--C 1.528 0.861 0 O-C-N 120.791 -1.193 . . . . 0.0 113.246 179.365 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 1.8 mt -118.66 115.86 25.39 Favored 'General case' 0 CA--C 1.508 -0.656 0 N-CA-C 102.685 -3.08 . . . . 0.0 102.685 179.448 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 3.1 t -46.72 160.54 0.08 Allowed 'General case' 0 C--N 1.323 -0.552 0 C-N-CA 125.615 1.566 . . . . 0.0 112.499 -179.031 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 9.2 m -47.06 -38.39 4.36 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.591 0 N-CA-C 114.13 1.159 . . . . 0.0 114.13 -177.72 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 42' ' ' SER . . . . . 0.44 ' HA ' HD11 ' B' ' 20' ' ' LEU . 6.9 p -66.05 -52.2 51.24 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-N 119.485 1.039 . . . . 0.0 109.898 179.153 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -56.88 -43.44 81.27 Favored 'General case' 0 CA--C 1.531 0.223 0 C-N-CA 124.185 0.994 . . . . 0.0 109.356 178.185 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 83.3 t80 -58.51 -52.28 66.32 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 124.04 0.936 . . . . 0.0 108.952 178.794 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 2.4 mm -53.39 -63.8 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.343 0.308 0 C-N-CA 126.176 1.79 . . . . 0.0 110.011 179.76 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 2.4 ptm180 -56.13 -43.02 77.8 Favored 'General case' 0 CA--C 1.516 -0.347 0 CA-C-O 117.675 -1.155 . . . . 0.0 111.637 -178.693 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 9.3 t30 -61.3 -54.71 40.51 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 119.459 1.027 . . . . 0.0 110.49 179.368 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -60.16 -32.92 71.5 Favored 'General case' 0 C--O 1.224 -0.282 0 C-N-CA 123.479 0.712 . . . . 0.0 112.157 -179.17 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -71.39 -27.04 63.04 Favored 'General case' 0 CA--C 1.535 0.382 0 N-CA-C 112.975 0.732 . . . . 0.0 112.975 -179.663 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 19.4 mt -92.48 -35.66 13.51 Favored 'General case' 0 CA--C 1.518 -0.267 0 C-N-CA 123.413 0.685 . . . . 0.0 109.81 -179.758 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 78.4 m-20 . . . . . 0 C--O 1.251 1.133 0 C-N-CA 125.334 1.454 . . . . 0.0 109.669 -180.0 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 1' ' ' SER . . . . . . . . . . . . . 6.2 p . . . . . 0 N--CA 1.466 0.368 0 N-CA-C 108.149 -1.056 . . . . 0.0 108.149 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 2' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -63.4 -22.0 66.62 Favored 'General case' 0 C--N 1.324 -0.534 0 C-N-CA 128.496 2.719 . . . . 0.0 111.508 -179.496 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 3' ' ' SER . . . . . . . . . . . . . 18.4 p -153.33 -177.54 6.4 Favored 'General case' 0 C--O 1.24 0.553 0 C-N-CA 125.701 1.6 . . . . 0.0 108.988 179.699 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 4' ' ' ALA . . . . . . . . . . . . . . . -128.19 161.4 29.39 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 126.443 1.897 . . . . 0.0 107.668 179.285 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 7.2 p -126.99 104.31 12.39 Favored 'Isoleucine or valine' 0 C--O 1.238 0.456 0 CA-C-O 122.043 0.925 . . . . 0.0 111.08 -178.797 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 6' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -92.66 143.5 26.25 Favored 'General case' 0 N--CA 1.463 0.219 0 C-N-CA 124.142 0.977 . . . . 0.0 108.392 179.056 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -160.62 160.38 31.61 Favored 'General case' 0 N--CA 1.467 0.393 0 C-N-CA 124.131 0.973 . . . . 0.0 110.702 179.676 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 24.4 mtpt 30.54 50.57 0.09 Allowed 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 129.566 3.146 . . . . 0.0 113.525 179.197 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 8.3 t -60.66 -70.67 0.16 Allowed 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 123.956 0.902 . . . . 0.0 111.851 -178.794 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 10' ' ' GLU . . . . . . . . . . . . . 5.1 tp10 -149.49 163.02 38.96 Favored 'General case' 0 C--O 1.235 0.3 0 O-C-N 121.093 -1.005 . . . . 0.0 109.177 -179.423 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 11' ' ' VAL . . . . . . . . . . . . . 13.7 t -139.83 94.37 0.77 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.27 0 N-CA-C 104.324 -2.473 . . . . 0.0 104.324 178.451 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 12' ' ' ARG . . . . . . . . . . . . . 37.4 ttm180 -141.68 166.0 25.95 Favored 'General case' 0 C--O 1.236 0.393 0 N-CA-C 108.068 -1.086 . . . . 0.0 108.068 -179.343 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 13' ' ' GLN . . . . . . . . . . . . . 16.2 mp0 -78.61 65.78 3.96 Favored 'General case' 0 C--O 1.234 0.27 0 N-CA-C 107.551 -1.277 . . . . 0.0 107.551 179.303 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 37.2 pttt -60.32 -38.79 84.83 Favored 'General case' 0 N--CA 1.452 -0.364 0 C-N-CA 124.767 1.227 . . . . 0.0 109.035 179.872 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 6.4 t -68.88 164.71 21.45 Favored 'General case' 0 N--CA 1.44 -0.967 0 CA-C-O 123.237 1.494 . . . . 0.0 109.885 178.363 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 36.4 t -102.42 146.53 10.31 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.873 0 N-CA-C 101.964 -3.347 . . . . 0.0 101.964 175.004 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 9.5 p -148.14 100.0 0.37 Allowed 'Isoleucine or valine' 0 N--CA 1.442 -0.861 0 N-CA-C 102.51 -3.144 . . . . 0.0 102.51 177.254 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 46.3 ttm-85 -142.34 160.51 40.11 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.057 -0.974 . . . . 0.0 109.282 -178.77 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -108.85 122.64 47.62 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 101.278 -3.601 . . . . 0.0 101.278 178.396 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 20' ' ' LEU . . . . . 0.44 HD11 ' HA ' ' A' ' 42' ' ' SER . 7.5 tt -134.44 112.62 11.08 Favored 'General case' 0 N--CA 1.463 0.208 0 C-N-CA 124.609 1.163 . . . . 0.0 109.199 -177.02 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 75.1 mtm-85 -78.98 162.45 25.95 Favored 'General case' 0 N--CA 1.47 0.562 0 N-CA-C 113.52 0.933 . . . . 0.0 113.52 -178.763 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 22' ' ' PHE . . . . . . . . . . . . . 45.4 m-85 -143.05 160.75 39.78 Favored 'General case' 0 N--CA 1.47 0.549 0 C-N-CA 127.117 2.167 . . . . 0.0 107.388 179.361 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 23' ' ' SER . . . . . 0.473 ' HB3' ' HD2' ' B' ' 24' ' ' PRO . 3.1 m -88.97 173.91 5.57 Favored Pre-proline 0 CA--C 1.545 0.756 0 C-N-CA 124.692 1.197 . . . . 0.0 109.899 179.823 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 24' ' ' PRO . . . . . 0.473 ' HD2' ' HB3' ' B' ' 23' ' ' SER . 55.7 Cg_endo -68.1 -47.47 1.72 Allowed 'Trans proline' 0 C--N 1.352 0.757 0 C-N-CA 121.687 1.591 . . . . 0.0 112.17 -178.543 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 25' ' ' VAL . . . . . . . . . . . . . 33.8 t -67.51 -31.23 51.76 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.388 0 C-N-CA 123.913 0.885 . . . . 0.0 110.296 -179.583 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 58.1 mt-10 -70.08 -48.7 56.66 Favored 'General case' 0 CA--C 1.529 0.137 0 N-CA-C 108.012 -1.107 . . . . 0.0 108.012 179.409 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 27' ' ' ASP . . . . . . . . . . . . . 23.8 t70 -60.38 -43.67 96.37 Favored 'General case' 0 C--O 1.219 -0.545 0 C-N-CA 124.968 1.307 . . . . 0.0 110.717 179.37 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 28' ' ' GLU . . . . . . . . . . . . . 12.9 tt0 -56.43 -52.2 65.54 Favored 'General case' 0 N--CA 1.454 -0.254 0 C-N-CA 124.768 1.227 . . . . 0.0 110.146 -179.696 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 4.1 m -56.71 -55.48 33.62 Favored 'General case' 0 CA--C 1.53 0.199 0 N-CA-C 109.118 -0.697 . . . . 0.0 109.118 178.96 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 73.2 mt -54.12 -50.92 51.58 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.202 0 C-N-CA 123.279 0.631 . . . . 0.0 110.845 -178.986 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 58.9 ttt180 -56.89 -48.31 78.47 Favored 'General case' 0 N--CA 1.449 -0.507 0 C-N-CA 124.587 1.155 . . . . 0.0 111.331 -178.952 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 1.9 mptm? -65.65 -45.98 80.93 Favored 'General case' 0 CA--C 1.515 -0.398 0 O-C-N 123.909 0.756 . . . . 0.0 110.379 -179.519 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 34.9 mmtt -62.47 -44.6 96.0 Favored 'General case' 0 C--N 1.333 -0.117 0 CA-C-N 119.455 1.025 . . . . 0.0 110.239 -179.02 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 34' ' ' ALA . . . . . . . . . . . . . . . -58.2 -54.61 45.05 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 124.866 1.267 . . . . 0.0 110.024 179.192 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 7.4 tp10 -66.57 -16.78 64.41 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 124.635 1.174 . . . . 0.0 112.775 -179.055 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 36' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -102.05 4.61 39.95 Favored 'General case' 0 C--N 1.327 -0.409 0 C-N-CA 126.015 1.726 . . . . 0.0 111.466 -179.899 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 37' ' ' SER . . . . . . . . . . . . . 9.1 t -127.59 -1.27 6.15 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 124.424 1.09 . . . . 0.0 112.094 179.825 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 67.79 28.72 73.45 Favored Glycine 0 CA--C 1.529 0.936 0 CA-C-N 119.876 1.216 . . . . 0.0 110.64 -178.892 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 39' ' ' LEU . . . . . . . . . . . . . 90.0 mt -120.1 125.24 47.79 Favored 'General case' 0 N--CA 1.444 -0.725 0 C-N-CA 126.041 1.736 . . . . 0.0 106.94 -179.061 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 40' ' ' THR . . . . . 0.543 HG23 ' H ' ' B' ' 43' ' ' ALA . 1.8 t -63.8 153.83 35.33 Favored 'General case' 0 CA--C 1.538 0.502 0 N-CA-C 104.703 -2.332 . . . . 0.0 104.703 176.8 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 41' ' ' VAL . . . . . . . . . . . . . 55.1 t -48.64 -38.75 10.01 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.498 0 O-C-N 121.392 -0.818 . . . . 0.0 110.261 179.071 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 42' ' ' SER . . . . . . . . . . . . . 14.4 m -62.39 -46.55 88.09 Favored 'General case' 0 CA--C 1.533 0.324 0 O-C-N 121.057 -1.027 . . . . 0.0 111.368 179.085 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 43' ' ' ALA . . . . . 0.543 ' H ' HG23 ' B' ' 40' ' ' THR . . . -64.9 -40.91 95.83 Favored 'General case' 0 C--N 1.34 0.164 0 C-N-CA 123.913 0.885 . . . . 0.0 109.23 178.803 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 44' ' ' TYR . . . . . . . . . . . . . 57.3 t80 -58.45 -50.92 71.99 Favored 'General case' 0 CA--C 1.539 0.54 0 N-CA-C 108.276 -1.009 . . . . 0.0 108.276 179.106 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 45' ' ' ILE . . . . . . . . . . . . . 12.9 mm -56.74 -61.32 1.26 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.301 0 C-N-CA 125.122 1.369 . . . . 0.0 108.609 178.807 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 46' ' ' ARG . . . . . . . . . . . . . 40.2 mtp180 -43.9 -66.01 0.43 Allowed 'General case' 0 C--O 1.219 -0.51 0 C-N-CA 126.044 1.738 . . . . 0.0 110.588 179.781 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 47' ' ' ASN . . . . . . . . . . . . . 20.5 t30 -53.25 -49.54 66.67 Favored 'General case' 0 N--CA 1.441 -0.88 0 C-N-CA 124.719 1.208 . . . . 0.0 113.601 -178.04 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -63.18 -31.62 72.81 Favored 'General case' 0 CA--C 1.535 0.399 0 CA-C-N 118.99 0.814 . . . . 0.0 111.264 179.514 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 49' ' ' ALA . . . . . . . . . . . . . . . -78.68 -16.09 57.7 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 124.067 0.947 . . . . 0.0 113.512 -179.712 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 13.9 mt -100.32 -38.02 8.63 Favored 'General case' 0 C--O 1.234 0.283 0 O-C-N 121.451 -0.781 . . . . 0.0 109.981 179.886 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 51' ' ' ASN . . . . . . . . . . . . . 43.2 m-80 . . . . . 0 C--O 1.246 0.907 0 C-N-CA 124.502 1.121 . . . . 0.0 110.136 179.155 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 5.2 t . . . . . 0 N--CA 1.471 0.589 0 N-CA-C 105.85 -1.907 . . . . 0.0 105.85 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -141.89 139.24 32.53 Favored 'General case' 0 C--O 1.236 0.37 0 CA-C-N 118.826 0.739 . . . . 0.0 109.721 -177.808 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 20.1 m -73.73 162.73 28.84 Favored 'General case' 0 CA--C 1.535 0.397 0 N-CA-C 108.736 -0.838 . . . . 0.0 108.736 178.978 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -126.58 -18.51 4.79 Favored 'General case' 0 C--O 1.235 0.339 0 N-CA-C 113.212 0.819 . . . . 0.0 113.212 -179.896 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 9.6 m -157.26 170.75 0.55 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.417 0 C-N-CA 128.231 2.613 . . . . 0.0 106.819 178.959 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 91.1 mtt180 -140.02 -75.84 0.34 Allowed 'General case' 0 N--CA 1.464 0.26 0 C-N-CA 123.321 0.649 . . . . 0.0 109.411 178.499 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 36.5 mtmt -121.53 155.84 34.12 Favored 'General case' 0 C--O 1.235 0.335 0 C-N-CA 124.324 1.05 . . . . 0.0 109.136 -179.595 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 95.4 mttt -132.79 167.83 19.45 Favored 'General case' 0 C--O 1.236 0.376 0 C-N-CA 124.957 1.303 . . . . 0.0 109.758 -179.566 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 31.7 p -152.07 173.01 15.42 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 108.893 -0.78 . . . . 0.0 108.893 178.999 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 22.8 tt0 -120.08 6.2 10.81 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 125.056 1.343 . . . . 0.0 110.49 179.64 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 9.8 p -113.9 5.34 7.82 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.66 0 C-N-CA 126.64 1.976 . . . . 0.0 110.643 179.793 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 13.6 tpt180 -128.27 105.9 8.66 Favored 'General case' 0 CA--C 1.515 -0.4 0 N-CA-C 107.105 -1.443 . . . . 0.0 107.105 179.81 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 2.3 pt20 -71.69 105.74 3.82 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 105.318 -2.104 . . . . 0.0 105.318 178.147 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' LYS . . . . . 0.41 ' H ' ' CE ' ' A' ' 14' ' ' LYS . 0.0 OUTLIER -59.19 -27.67 65.92 Favored 'General case' 0 N--CA 1.465 0.311 0 C-N-CA 122.819 0.448 . . . . 0.0 111.285 179.618 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 12.2 t -76.51 -176.86 3.89 Favored 'General case' 0 N--CA 1.436 -1.159 0 CA-C-O 124.107 1.908 . . . . 0.0 110.89 178.966 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 16.1 t -122.92 144.19 33.26 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.961 1 N-CA-C 100.072 -4.047 . . . . 0.0 100.072 176.51 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 13.1 p -136.9 102.08 2.57 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.021 0 N-CA-C 104.244 -2.502 . . . . 0.0 104.244 179.234 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 6.0 mtt-85 -128.25 158.96 36.7 Favored 'General case' 0 CA--C 1.509 -0.603 0 CA-C-O 123.103 1.43 . . . . 0.0 109.792 -179.969 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 3.7 m -94.2 83.21 4.21 Favored 'General case' 0 N--CA 1.439 -1.003 0 N-CA-C 104.049 -2.574 . . . . 0.0 104.049 -179.234 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -84.17 92.67 7.98 Favored 'General case' 0 C--N 1.325 -0.458 0 C-N-CA 124.294 1.037 . . . . 0.0 111.058 -177.771 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -74.2 146.48 43.34 Favored 'General case' 0 N--CA 1.447 -0.596 0 C-N-CA 123.961 0.904 . . . . 0.0 112.666 179.204 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 90.5 m-85 -137.11 152.29 49.83 Favored 'General case' 0 C--O 1.238 0.458 0 C-N-CA 126.624 1.97 . . . . 0.0 106.088 177.274 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 1.2 m -86.52 167.68 21.82 Favored Pre-proline 0 CA--C 1.543 0.692 0 N-CA-C 106.59 -1.633 . . . . 0.0 106.59 179.438 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -66.76 -30.84 40.73 Favored 'Trans proline' 0 CA--C 1.531 0.368 0 CA-C-N 121.201 1.465 . . . . 0.0 111.428 -179.355 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 44.8 t -69.32 -45.29 79.35 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.322 0 N-CA-C 108.456 -0.942 . . . . 0.0 108.456 179.308 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -64.37 -46.24 84.26 Favored 'General case' 0 C--O 1.224 -0.276 0 N-CA-C 109.52 -0.548 . . . . 0.0 109.52 -179.789 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -58.35 -44.21 88.66 Favored 'General case' 0 CA--C 1.513 -0.458 0 C-N-CA 123.874 0.87 . . . . 0.0 111.233 -179.772 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 15.3 tm-20 -62.24 -51.39 67.95 Favored 'General case' 0 N--CA 1.448 -0.565 0 N-CA-C 109.166 -0.679 . . . . 0.0 109.166 179.856 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 88.9 m -59.38 -53.41 58.56 Favored 'General case' 0 CA--C 1.534 0.34 0 CA-C-N 118.353 0.524 . . . . 0.0 110.009 179.482 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 83.9 mt -57.97 -43.53 85.0 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.293 0 C-N-CA 124.193 0.997 . . . . 0.0 109.861 -179.283 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 40.8 ttt180 -62.94 -42.23 99.74 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-N 119.296 0.953 . . . . 0.0 110.16 -179.63 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 4.7 mptp? -68.98 -47.71 64.91 Favored 'General case' 0 CA--C 1.515 -0.38 0 CA-C-O 118.843 -0.598 . . . . 0.0 109.864 -179.554 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 21.3 tptt -63.01 -41.1 99.48 Favored 'General case' 0 C--O 1.224 -0.27 0 CA-C-O 119.005 -0.521 . . . . 0.0 110.536 -179.488 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -61.08 -53.45 57.0 Favored 'General case' 0 N--CA 1.453 -0.294 0 C-N-CA 124.841 1.257 . . . . 0.0 109.236 179.071 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 30.5 tt0 -57.84 -44.23 86.38 Favored 'General case' 0 N--CA 1.453 -0.303 0 C-N-CA 122.966 0.507 . . . . 0.0 111.17 -179.299 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 27.0 t0 -67.33 -39.61 85.86 Favored 'General case' 0 C--N 1.332 -0.156 0 C-N-CA 123.378 0.671 . . . . 0.0 109.9 -179.85 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 22.9 t -72.3 -9.17 58.14 Favored 'General case' 0 N--CA 1.451 -0.403 0 C-N-CA 124.53 1.132 . . . . 0.0 111.007 179.66 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 65.49 29.76 75.95 Favored Glycine 0 CA--C 1.53 1.012 0 CA-C-N 119.391 0.996 . . . . 0.0 111.683 -179.682 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 71.6 mt -133.42 115.65 15.09 Favored 'General case' 0 N--CA 1.451 -0.42 0 N-CA-C 103.797 -2.668 . . . . 0.0 103.797 179.703 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 14.8 t -57.13 161.65 3.01 Favored 'General case' 0 CA--C 1.535 0.391 0 CA-C-N 119.276 0.944 . . . . 0.0 110.19 -179.843 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 97.7 t -44.19 -45.77 2.24 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.213 0 C-N-CA 126.118 1.767 . . . . 0.0 111.555 -178.812 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 2.5 p -64.19 -47.49 79.58 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-N 120.304 1.411 . . . . 0.0 112.076 -179.806 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -62.1 -44.28 97.0 Favored 'General case' 0 C--O 1.222 -0.353 0 C-N-CA 124.412 1.085 . . . . 0.0 109.176 178.69 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 61.2 t80 -59.27 -51.07 71.55 Favored 'General case' 0 N--CA 1.453 -0.322 0 C-N-CA 125.403 1.481 . . . . 0.0 108.798 179.073 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.411 HG23 HG23 ' B' ' 45' ' ' ILE . 13.8 mm -55.19 -60.32 1.73 Allowed 'Isoleucine or valine' 0 C--O 1.226 -0.132 0 C-N-CA 124.408 1.083 . . . . 0.0 110.163 179.705 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 21.2 ptt180 -59.93 -44.64 94.21 Favored 'General case' 0 C--O 1.219 -0.524 0 CA-C-O 118.366 -0.826 . . . . 0.0 110.499 -179.2 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 18.0 t30 -53.57 -56.73 14.6 Favored 'General case' 0 CA--C 1.519 -0.215 0 CA-C-N 119.374 0.988 . . . . 0.0 110.079 179.875 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -61.42 -33.13 73.19 Favored 'General case' 0 N--CA 1.453 -0.284 0 C-N-CA 124.174 0.99 . . . . 0.0 112.245 -179.81 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -75.5 -24.42 56.85 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 123.441 0.696 . . . . 0.0 112.874 -179.588 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 11.8 mt -98.55 -29.19 13.22 Favored 'General case' 0 N--CA 1.465 0.298 0 C-N-CA 123.583 0.753 . . . . 0.0 111.325 -179.399 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 43.3 m-80 . . . . . 0 C--O 1.243 0.75 0 C-N-CA 126.655 1.982 . . . . 0.0 108.378 -179.846 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 1' ' ' SER . . . . . . . . . . . . . 6.8 t . . . . . 0 CA--C 1.509 -0.612 0 N-CA-C 103.039 -2.948 . . . . 0.0 103.039 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 2' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -140.58 160.95 38.89 Favored 'General case' 0 C--O 1.235 0.34 0 O-C-N 123.418 0.449 . . . . 0.0 110.938 -176.428 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 3' ' ' SER . . . . . . . . . . . . . 17.4 m -110.98 154.79 23.64 Favored 'General case' 0 C--O 1.236 0.38 0 C-N-CA 125.184 1.394 . . . . 0.0 109.308 179.245 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 4' ' ' ALA . . . . . . . . . . . . . . . -133.37 -44.96 0.83 Allowed 'General case' 0 C--O 1.235 0.291 0 C-N-CA 125.297 1.439 . . . . 0.0 109.012 179.5 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 9.7 p -136.12 152.52 30.39 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.315 0 C-N-CA 126.006 1.722 . . . . 0.0 108.553 179.729 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 6' ' ' ARG . . . . . . . . . . . . . 80.3 mtt180 -132.26 -68.84 0.61 Allowed 'General case' 0 C--N 1.332 -0.154 0 N-CA-C 106.119 -1.808 . . . . 0.0 106.119 179.01 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 19.8 pttt -129.4 176.4 7.99 Favored 'General case' 0 C--O 1.235 0.313 0 C-N-CA 124.111 0.965 . . . . 0.0 110.097 179.411 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 17.9 pttt -143.34 -177.44 5.38 Favored 'General case' 0 C--O 1.236 0.385 0 C-N-CA 126.057 1.743 . . . . 0.0 109.5 -179.884 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 6.2 p -160.93 174.73 13.38 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 126.248 1.819 . . . . 0.0 110.151 -178.564 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 10' ' ' GLU . . . . . . . . . . . . . 15.6 tt0 -141.18 2.29 1.69 Allowed 'General case' 0 N--CA 1.469 0.501 0 N-CA-C 115.203 1.557 . . . . 0.0 115.203 -179.618 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 11' ' ' VAL . . . . . . . . . . . . . 14.3 m -116.02 31.43 1.8 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 C-N-CA 125.045 1.338 . . . . 0.0 109.815 179.504 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 12' ' ' ARG . . . . . . . . . . . . . 2.7 tpt180 -151.29 147.93 27.56 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 128.415 2.686 . . . . 0.0 105.095 -179.609 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 13' ' ' GLN . . . . . . . . . . . . . 82.8 mt-30 -116.74 102.77 9.71 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-N 119.851 1.205 . . . . 0.0 109.1 -179.206 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 8.2 ptmt -69.27 -32.17 71.17 Favored 'General case' 0 N--CA 1.464 0.242 0 C-N-CA 123.238 0.615 . . . . 0.0 110.65 179.956 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 4.5 t -72.11 165.49 24.22 Favored 'General case' 0 N--CA 1.442 -0.841 0 N-CA-C 108.852 -0.796 . . . . 0.0 108.852 178.536 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 21.4 t -105.56 120.28 56.1 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.53 0 N-CA-C 104.58 -2.378 . . . . 0.0 104.58 178.674 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 9.4 p -115.59 90.7 1.58 Allowed 'Isoleucine or valine' 0 N--CA 1.447 -0.6 0 N-CA-C 106.233 -1.766 . . . . 0.0 106.233 178.717 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -117.77 161.64 19.37 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 114.234 -1.348 . . . . 0.0 109.185 -179.857 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 56.3 m -104.99 88.68 2.93 Favored 'General case' 0 N--CA 1.448 -0.526 0 N-CA-C 105.155 -2.165 . . . . 0.0 105.155 -179.654 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -90.7 105.6 17.94 Favored 'General case' 0 C--N 1.324 -0.514 0 C-N-CA 125.612 1.565 . . . . 0.0 110.894 -178.47 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 1.4 mpp_? -82.55 154.07 25.21 Favored 'General case' 0 N--CA 1.455 -0.216 0 C-N-CA 123.548 0.739 . . . . 0.0 111.555 178.847 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 22' ' ' PHE . . . . . . . . . . . . . 81.7 m-85 -138.35 141.69 39.7 Favored 'General case' 0 CA--C 1.516 -0.342 0 N-CA-C 106.624 -1.621 . . . . 0.0 106.624 178.129 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 14.5 m -71.61 165.76 46.12 Favored Pre-proline 0 CA--C 1.539 0.556 0 N-CA-C 109.318 -0.623 . . . . 0.0 109.318 179.653 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 24' ' ' PRO . . . . . . . . . . . . . 33.9 Cg_endo -62.36 -38.52 53.04 Favored 'Trans proline' 0 C--N 1.348 0.529 0 C-N-CA 121.457 1.438 . . . . 0.0 111.145 -179.4 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 25' ' ' VAL . . . . . . . . . . . . . 60.5 t -65.42 -49.39 78.71 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.254 0 C-N-CA 124.433 1.093 . . . . 0.0 109.346 179.41 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 54.8 mt-10 -58.96 -49.33 78.26 Favored 'General case' 0 C--O 1.223 -0.335 0 C-N-CA 124.097 0.959 . . . . 0.0 109.743 -179.716 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 27' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -59.83 -39.04 83.73 Favored 'General case' 0 N--CA 1.453 -0.306 0 C-N-CA 124.753 1.221 . . . . 0.0 111.771 -179.832 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 28' ' ' GLU . . . . . . . . . . . . . 12.4 tt0 -66.61 -53.33 35.44 Favored 'General case' 0 N--CA 1.453 -0.315 0 N-CA-C 109.231 -0.655 . . . . 0.0 109.231 179.551 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 64.8 m -57.63 -50.58 72.67 Favored 'General case' 0 N--CA 1.454 -0.251 0 C-N-CA 124.064 0.945 . . . . 0.0 110.02 179.438 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 81.3 mt -60.78 -42.93 94.12 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.354 0 C-N-CA 123.564 0.746 . . . . 0.0 109.275 -179.676 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 56.8 ttt180 -61.42 -51.01 70.52 Favored 'General case' 0 CA--C 1.519 -0.213 0 CA-C-N 119.296 0.953 . . . . 0.0 110.211 179.261 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 5.0 mptp? -60.77 -44.16 97.11 Favored 'General case' 0 CA--C 1.52 -0.195 0 CA-C-N 118.371 0.532 . . . . 0.0 110.388 -179.293 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 34.4 tptt -68.81 -38.99 80.29 Favored 'General case' 0 CA--C 1.528 0.129 0 CA-C-N 118.865 0.757 . . . . 0.0 111.088 -179.631 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 34' ' ' ALA . . . . . . . . . . . . . . . -65.81 -36.25 82.97 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-O 122.577 1.18 . . . . 0.0 109.348 178.825 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 20.6 tt0 -75.7 -19.39 59.14 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 124.137 0.975 . . . . 0.0 110.294 179.433 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 36' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -86.19 -45.55 11.22 Favored 'General case' 0 C--O 1.232 0.169 0 C-N-CA 125.561 1.544 . . . . 0.0 109.856 179.109 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 37' ' ' SER . . . . . . . . . . . . . 48.0 t -79.16 -10.96 59.96 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-O 118.787 -0.625 . . . . 0.0 109.914 -179.911 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 82.39 -7.69 63.75 Favored Glycine 0 C--N 1.338 0.685 0 C-N-CA 124.975 1.274 . . . . 0.0 115.165 178.227 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 39' ' ' LEU . . . . . . . . . . . . . 13.8 mt -96.44 125.48 40.96 Favored 'General case' 0 CA--C 1.518 -0.253 0 CA-C-N 120.235 2.017 . . . . 0.0 105.85 -179.519 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 40' ' ' THR . . . . . . . . . . . . . 5.3 t -45.85 151.32 0.46 Allowed 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 125.202 1.401 . . . . 0.0 110.497 179.851 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 41' ' ' VAL . . . . . . . . . . . . . 53.3 t -45.73 -46.41 4.93 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.218 0 C-N-CA 125.307 1.443 . . . . 0.0 111.772 -179.047 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 42' ' ' SER . . . . . . . . . . . . . 9.6 p -55.55 -45.38 77.27 Favored 'General case' 0 C--O 1.235 0.291 0 O-C-N 121.747 -0.596 . . . . 0.0 112.188 -179.967 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -70.23 -46.74 63.86 Favored 'General case' 0 C--O 1.222 -0.391 0 C-N-CA 124.582 1.153 . . . . 0.0 108.854 178.936 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 44' ' ' TYR . . . . . . . . . . . . . 38.8 t80 -49.61 -50.58 42.23 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 124.626 1.17 . . . . 0.0 109.08 179.662 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 45' ' ' ILE . . . . . 0.411 HG23 HG23 ' A' ' 45' ' ' ILE . 21.6 mm -54.44 -61.19 1.04 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.421 0 C-N-CA 124.085 0.954 . . . . 0.0 111.395 179.457 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 46' ' ' ARG . . . . . . . . . . . . . 12.1 ptm180 -59.91 -43.97 94.56 Favored 'General case' 0 N--CA 1.467 0.396 0 O-C-N 121.736 -0.602 . . . . 0.0 111.704 -178.766 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 47' ' ' ASN . . . . . . . . . . . . . 20.6 t30 -56.95 -57.16 13.73 Favored 'General case' 0 N--CA 1.449 -0.509 0 C-N-CA 124.392 1.077 . . . . 0.0 110.76 -179.113 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -61.95 -33.41 74.23 Favored 'General case' 0 N--CA 1.453 -0.281 0 C-N-CA 124.404 1.081 . . . . 0.0 111.708 -179.968 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 49' ' ' ALA . . . . . . . . . . . . . . . -68.56 -42.24 78.64 Favored 'General case' 0 N--CA 1.451 -0.376 0 O-C-N 121.703 -0.623 . . . . 0.0 112.114 -179.11 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 12.5 mt -80.46 -36.03 34.08 Favored 'General case' 0 C--N 1.328 -0.362 0 C-N-CA 123.115 0.566 . . . . 0.0 112.061 -178.844 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 51' ' ' ASN . . . . . . . . . . . . . 46.7 m-80 . . . . . 0 C--O 1.248 1.0 0 CA-C-O 117.362 -1.304 . . . . 0.0 109.769 -179.077 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 15.0 m . . . . . 0 N--CA 1.481 1.09 0 N-CA-C 108.476 -0.935 . . . . 0.0 108.476 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 3.9 p-10 -18.07 -70.55 0.01 OUTLIER 'General case' 0 CA--C 1.537 0.468 1 C-N-CA 134.062 4.945 . . . . 0.0 113.998 176.369 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 68.1 m -63.1 26.39 0.01 OUTLIER 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 131.671 3.989 . . . . 0.0 116.125 -178.71 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -48.46 -29.75 4.43 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 125.086 1.354 . . . . 0.0 112.477 179.693 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 19.1 m -50.28 -40.32 17.72 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.492 0 CA-C-N 120.152 1.342 . . . . 0.0 112.178 178.674 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 82.0 mtt85 -61.59 -3.61 1.1 Allowed 'General case' 0 N--CA 1.463 0.218 0 N-CA-C 115.745 1.757 . . . . 0.0 115.745 -178.07 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -118.58 -3.18 10.89 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 120.182 1.355 . . . . 0.0 112.587 178.426 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 6.2 ttpp 175.24 108.27 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.24 0 C-N-CA 127.352 2.261 . . . . 0.0 106.435 179.857 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 15.9 p -151.59 170.1 20.5 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 118.862 0.755 . . . . 0.0 108.998 179.181 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.3 pm0 -96.68 160.62 14.28 Favored 'General case' 0 C--O 1.239 0.502 0 N-CA-C 106.417 -1.698 . . . . 0.0 106.417 177.803 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 14.9 p -112.31 110.25 31.52 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.614 0 CA-C-O 121.682 0.753 . . . . 0.0 109.168 179.832 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 27.3 ptt85 -58.49 110.83 1.05 Allowed 'General case' 0 C--O 1.236 0.388 0 C-N-CA 126.774 2.03 . . . . 0.0 107.155 178.737 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 33.1 mt-30 -77.6 85.14 3.95 Favored 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 123.76 0.824 . . . . 0.0 110.02 -179.148 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 46.0 pttt -66.08 -14.73 62.24 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 123.395 0.678 . . . . 0.0 111.624 178.257 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 14.6 t -74.68 179.47 4.75 Favored 'General case' 0 N--CA 1.446 -0.674 0 N-CA-C 107.048 -1.464 . . . . 0.0 107.048 177.718 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 36.2 t -119.56 129.31 75.49 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.672 0 N-CA-C 104.108 -2.553 . . . . 0.0 104.108 178.92 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 14.3 p -122.0 98.97 6.35 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.515 0 N-CA-C 102.842 -3.021 . . . . 0.0 102.842 178.202 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 62.4 mtt-85 -140.42 164.9 28.88 Favored 'General case' 0 CA--C 1.51 -0.565 0 CA-C-N 115.021 -0.99 . . . . 0.0 110.119 -179.279 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -110.39 148.76 31.37 Favored 'General case' 0 N--CA 1.444 -0.73 0 C-N-CA 125.216 1.406 . . . . 0.0 107.615 179.272 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 58.2 mt -145.09 112.87 6.33 Favored 'General case' 0 CA--C 1.51 -0.558 0 N-CA-C 107.228 -1.397 . . . . 0.0 107.228 178.749 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 14.8 mtm180 -86.42 152.17 22.92 Favored 'General case' 0 C--O 1.238 0.492 0 N-CA-C 107.416 -1.327 . . . . 0.0 107.416 178.052 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 87.7 m-85 -132.8 140.08 47.83 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 105.415 -2.069 . . . . 0.0 105.415 179.58 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -66.76 173.15 2.66 Favored Pre-proline 0 CA--C 1.552 1.037 0 CA-C-N 119.324 0.965 . . . . 0.0 109.53 -179.841 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 28.9 Cg_endo -63.44 -42.29 22.42 Favored 'Trans proline' 0 C--N 1.348 0.517 0 C-N-CA 121.845 1.697 . . . . 0.0 112.983 -178.029 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 38.4 t -67.11 -40.05 84.51 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.306 0 C-N-CA 123.613 0.765 . . . . 0.0 109.653 -179.995 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 -66.26 -44.18 84.35 Favored 'General case' 0 CA--C 1.521 -0.171 0 C-N-CA 124.94 1.296 . . . . 0.0 111.089 -178.791 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 34.5 t70 -61.88 -49.11 77.54 Favored 'General case' 0 CA--C 1.502 -0.89 0 N-CA-C 108.289 -1.004 . . . . 0.0 108.289 179.22 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 44.8 tt0 -52.52 -43.77 65.33 Favored 'General case' 0 N--CA 1.445 -0.714 0 CA-C-O 118.325 -0.845 . . . . 0.0 110.941 179.945 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 32.4 m -65.92 -54.92 20.15 Favored 'General case' 0 CA--C 1.529 0.154 0 CA-C-N 118.837 0.744 . . . . 0.0 109.631 179.185 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 79.9 mt -63.11 -25.6 38.92 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.325 0 CA-C-O 121.724 0.773 . . . . 0.0 111.784 -178.661 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 42.2 ttt180 -77.84 -45.46 24.26 Favored 'General case' 0 C--N 1.316 -0.882 0 O-C-N 119.826 -1.796 . . . . 0.0 107.582 179.526 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 5.6 mptt -68.47 -47.28 67.53 Favored 'General case' 0 CA--C 1.519 -0.22 0 CA-C-O 118.167 -0.92 . . . . 0.0 112.78 179.879 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 29.3 tptt -67.97 -33.67 75.09 Favored 'General case' 0 CA--C 1.523 -0.081 0 CA-C-N 120.407 1.458 . . . . 0.0 111.746 -177.941 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -67.13 -54.88 17.17 Favored 'General case' 0 C--N 1.331 -0.207 0 C-N-CA 125.249 1.42 . . . . 0.0 108.212 179.599 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 22.7 tt0 -60.13 -39.99 88.22 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-N 115.48 -0.782 . . . . 0.0 111.213 -179.143 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -64.95 -41.25 95.66 Favored 'General case' 0 N--CA 1.462 0.126 0 C-N-CA 124.857 1.263 . . . . 0.0 109.984 179.111 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 35.7 m -79.57 -9.05 59.56 Favored 'General case' 0 N--CA 1.448 -0.574 0 C-N-CA 123.741 0.817 . . . . 0.0 112.706 -179.388 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 75.15 13.56 82.63 Favored Glycine 0 CA--C 1.531 1.045 0 CA-C-N 119.377 0.99 . . . . 0.0 113.508 -179.972 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 13.0 mt -115.77 116.43 28.03 Favored 'General case' 0 CA--C 1.511 -0.549 0 N-CA-C 104.379 -2.452 . . . . 0.0 104.379 179.047 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 9.9 t -53.47 157.39 2.11 Favored 'General case' 0 CA--C 1.537 0.449 0 N-CA-C 109.486 -0.561 . . . . 0.0 109.486 179.062 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 61.0 t -45.62 -43.86 4.08 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.206 0 C-N-CA 125.223 1.409 . . . . 0.0 111.551 -179.457 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 97.7 p -59.68 -50.36 74.16 Favored 'General case' 0 CA--C 1.545 0.752 0 CA-C-N 119.44 1.018 . . . . 0.0 111.206 -179.42 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.5 -42.55 98.5 Favored 'General case' 0 C--N 1.339 0.126 0 C-N-CA 124.302 1.041 . . . . 0.0 109.743 179.161 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 67.9 t80 -57.46 -53.33 59.42 Favored 'General case' 0 N--CA 1.45 -0.467 0 N-CA-C 109.335 -0.617 . . . . 0.0 109.335 179.211 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 23.3 mm -54.13 -54.83 17.84 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.152 0 C-N-CA 124.269 1.027 . . . . 0.0 111.372 -179.292 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 13.2 ptt180 -60.78 -50.84 71.83 Favored 'General case' 0 N--CA 1.464 0.266 0 O-C-N 121.609 -0.682 . . . . 0.0 111.397 -179.615 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 22.9 t30 -55.41 -58.37 8.04 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 118.667 -0.682 . . . . 0.0 110.463 -179.562 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -57.14 -31.97 65.89 Favored 'General case' 0 N--CA 1.456 -0.138 0 C-N-CA 124.106 0.963 . . . . 0.0 113.297 -178.934 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -79.81 -33.21 40.61 Favored 'General case' 0 CA--C 1.531 0.248 0 N-CA-C 114.396 1.258 . . . . 0.0 114.396 -179.18 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 13.8 mt -82.98 -33.42 26.62 Favored 'General case' 0 N--CA 1.47 0.53 0 CA-C-N 118.5 0.591 . . . . 0.0 111.316 -178.988 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 3.4 m-80 . . . . . 0 C--O 1.249 1.028 0 C-N-CA 124.646 1.179 . . . . 0.0 108.335 179.107 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 1' ' ' SER . . . . . . . . . . . . . 15.8 m . . . . . 0 N--CA 1.485 1.288 0 N-CA-C 113.402 0.89 . . . . 0.0 113.402 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 2' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -65.52 -177.02 0.39 Allowed 'General case' 0 C--N 1.323 -0.579 1 C-N-CA 136.417 5.887 . . . . 0.0 112.798 -178.302 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 3' ' ' SER . . . . . . . . . . . . . 24.1 m 60.75 10.12 2.52 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 125.744 1.618 . . . . 0.0 114.598 179.643 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 4' ' ' ALA . . . . . . . . . . . . . . . -52.68 -28.22 20.83 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 124.744 1.217 . . . . 0.0 112.408 -179.779 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 14.0 p -49.25 -32.04 5.36 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.567 0 C-N-CA 126.177 1.791 . . . . 0.0 112.537 178.957 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 6' ' ' ARG . . . . . . . . . . . . . 53.9 mtt85 -94.37 -30.83 14.29 Favored 'General case' 0 N--CA 1.47 0.551 0 CA-C-N 119.799 1.182 . . . . 0.0 110.68 178.763 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.81 -38.35 78.42 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-N 119.392 0.996 . . . . 0.0 108.932 179.244 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 18.2 ttmm -159.73 155.48 26.03 Favored 'General case' 0 N--CA 1.454 -0.275 0 N-CA-C 107.384 -1.339 . . . . 0.0 107.384 178.286 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 61.0 p 115.66 145.97 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.504 1 C-N-CA 132.504 4.322 . . . . 0.0 109.991 179.04 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 10' ' ' GLU . . . . . . . . . . . . . 1.6 pm0 -148.39 85.13 1.51 Allowed 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 125.358 1.463 . . . . 0.0 107.868 -179.156 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 11' ' ' VAL . . . . . . . . . . . . . 46.6 t -125.82 81.85 0.74 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.338 0 N-CA-C 108.129 -1.064 . . . . 0.0 108.129 -179.042 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 12' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -145.19 99.97 3.4 Favored 'General case' 0 C--O 1.235 0.324 0 C-N-CA 124.24 1.016 . . . . 0.0 108.301 179.846 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 13' ' ' GLN . . . . . . . . . . . . . 16.9 mt-30 -134.04 35.86 3.28 Favored 'General case' 0 N--CA 1.467 0.394 0 C-N-CA 123.487 0.715 . . . . 0.0 110.134 178.773 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 41.3 pttt -46.93 -24.03 0.54 Allowed 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 127.731 2.412 . . . . 0.0 114.142 179.439 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 12.4 t -75.27 -154.35 0.04 OUTLIER 'General case' 0 N--CA 1.441 -0.883 0 C-N-CA 126.392 1.877 . . . . 0.0 107.35 178.149 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 21.1 t -138.11 152.85 26.32 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.516 0 N-CA-C 106.762 -1.57 . . . . 0.0 106.762 -179.905 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 9.8 p -141.62 104.19 1.3 Allowed 'Isoleucine or valine' 0 N--CA 1.441 -0.891 0 N-CA-C 104.46 -2.422 . . . . 0.0 104.46 177.795 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 30.2 mtt-85 -149.66 152.98 36.28 Favored 'General case' 0 CA--C 1.517 -0.31 0 O-C-N 121.708 -0.62 . . . . 0.0 110.636 -179.323 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 2.3 m -100.36 145.13 28.54 Favored 'General case' 0 C--N 1.327 -0.412 0 C-N-CA 124.909 1.283 . . . . 0.0 108.584 -179.515 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 61.3 mt -134.79 112.84 11.05 Favored 'General case' 0 CA--C 1.52 -0.183 0 N-CA-C 107.699 -1.223 . . . . 0.0 107.699 178.871 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 21.8 mmm-85 -82.52 118.16 23.05 Favored 'General case' 0 C--O 1.233 0.234 0 C-N-CA 124.56 1.144 . . . . 0.0 108.747 179.706 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 22' ' ' PHE . . . . . . . . . . . . . 96.7 m-85 -113.55 155.71 24.92 Favored 'General case' 0 N--CA 1.475 0.808 0 CA-C-N 119.725 1.148 . . . . 0.0 108.421 179.427 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -85.91 168.17 20.75 Favored Pre-proline 0 CA--C 1.541 0.619 0 N-CA-C 107.607 -1.257 . . . . 0.0 107.607 179.509 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 24' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_endo -62.77 -33.21 77.08 Favored 'Trans proline' 0 N--CA 1.459 -0.504 0 C-N-CA 121.611 1.54 . . . . 0.0 112.868 -178.835 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 25' ' ' VAL . . . . . . . . . . . . . 26.3 t -68.25 -57.0 10.57 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.187 0 C-N-CA 124.154 0.982 . . . . 0.0 108.907 179.566 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 2.4 mp0 -55.29 -42.5 73.7 Favored 'General case' 0 CA--C 1.529 0.143 0 C-N-CA 123.568 0.747 . . . . 0.0 110.972 -179.703 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 27' ' ' ASP . . . . . . . . . . . . . 5.0 t70 -63.47 -44.66 93.79 Favored 'General case' 0 C--O 1.224 -0.282 0 C-N-CA 123.476 0.71 . . . . 0.0 109.956 178.776 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 28' ' ' GLU . . . . . . . . . . . . . 19.1 tt0 -58.5 -49.06 78.75 Favored 'General case' 0 N--CA 1.45 -0.464 0 N-CA-C 109.285 -0.635 . . . . 0.0 109.285 179.762 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 88.4 m -58.9 -54.68 44.34 Favored 'General case' 0 N--CA 1.452 -0.362 0 C-N-CA 124.835 1.254 . . . . 0.0 109.686 179.816 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 63.8 mt -59.59 -44.98 94.49 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.132 0 CA-C-N 118.302 0.501 . . . . 0.0 110.461 -179.54 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 77.0 ttt180 -59.08 -47.86 83.71 Favored 'General case' 0 C--O 1.235 0.32 0 C-N-CA 123.4 0.68 . . . . 0.0 110.75 -179.14 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 9.2 mptt -62.85 -50.44 70.93 Favored 'General case' 0 CA--C 1.512 -0.494 0 O-C-N 123.812 0.695 . . . . 0.0 109.621 179.27 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 9.1 tptt -62.23 -38.83 90.71 Favored 'General case' 0 CA--C 1.516 -0.349 0 CA-C-O 118.609 -0.71 . . . . 0.0 112.322 -177.858 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 34' ' ' ALA . . . . . . . . . . . . . . . -58.47 -52.73 64.38 Favored 'General case' 0 N--CA 1.45 -0.439 0 N-CA-C 108.251 -1.018 . . . . 0.0 108.251 178.47 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 11.7 tt0 -68.01 -34.98 77.53 Favored 'General case' 0 CA--C 1.533 0.322 0 N-CA-C 113.003 0.742 . . . . 0.0 113.003 -178.853 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 36' ' ' ASP . . . . . . . . . . . . . 30.3 t70 -65.03 -40.78 95.35 Favored 'General case' 0 C--N 1.332 -0.18 0 C-N-CA 125.122 1.369 . . . . 0.0 108.847 179.389 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 37' ' ' SER . . . . . . . . . . . . . 72.4 m -79.77 -12.89 59.76 Favored 'General case' 0 N--CA 1.45 -0.435 0 C-N-CA 123.09 0.556 . . . . 0.0 110.58 178.459 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 79.07 23.55 63.39 Favored Glycine 0 CA--C 1.523 0.589 0 CA-C-O 118.219 -1.323 . . . . 0.0 114.716 179.012 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 39' ' ' LEU . . . . . . . . . . . . . 33.4 mt -122.55 147.49 46.32 Favored 'General case' 0 N--CA 1.455 -0.213 0 CA-C-N 119.898 1.849 . . . . 0.0 106.106 179.225 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 40' ' ' THR . . . . . . . . . . . . . 5.5 t -64.31 152.46 41.08 Favored 'General case' 0 C--N 1.324 -0.509 0 O-C-N 120.959 -1.088 . . . . 0.0 108.251 179.298 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 41' ' ' VAL . . . . . . . . . . . . . 42.0 t -49.94 -44.84 21.84 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.353 0 O-C-N 121.242 -0.911 . . . . 0.0 110.691 179.399 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 42' ' ' SER . . . . . . . . . . . . . 3.7 p -59.74 -35.6 74.91 Favored 'General case' 0 CA--C 1.542 0.645 0 O-C-N 121.178 -0.951 . . . . 0.0 111.776 -179.863 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -75.93 -43.16 46.33 Favored 'General case' 0 C--O 1.22 -0.489 0 C-N-CA 124.186 0.994 . . . . 0.0 108.595 178.465 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 44' ' ' TYR . . . . . . . . . . . . . 56.3 t80 -55.54 -48.02 75.38 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 124.098 0.959 . . . . 0.0 108.744 178.927 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 45' ' ' ILE . . . . . . . . . . . . . 26.0 mm -61.32 -55.9 21.47 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.151 0 C-N-CA 123.718 0.807 . . . . 0.0 111.72 179.747 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 46' ' ' ARG . . . . . . . . . . . . . 21.0 ptt180 -59.13 -44.04 92.02 Favored 'General case' 0 C--O 1.222 -0.348 0 CA-C-N 118.863 0.756 . . . . 0.0 109.764 -179.259 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 47' ' ' ASN . . . . . . . . . . . . . 15.3 t30 -56.51 -59.65 4.68 Favored 'General case' 0 N--CA 1.451 -0.399 0 C-N-CA 124.24 1.016 . . . . 0.0 110.714 179.916 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -58.58 -31.58 68.15 Favored 'General case' 0 CA--C 1.529 0.158 0 N-CA-C 113.456 0.91 . . . . 0.0 113.456 -178.767 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 49' ' ' ALA . . . . . . . . . . . . . . . -78.91 -34.7 44.43 Favored 'General case' 0 N--CA 1.452 -0.357 0 N-CA-C 113.773 1.027 . . . . 0.0 113.773 -179.368 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 30.7 mt -81.23 -35.15 31.6 Favored 'General case' 0 C--N 1.329 -0.316 0 O-C-N 121.59 -0.694 . . . . 0.0 112.408 -178.976 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 51' ' ' ASN . . . . . . . . . . . . . 35.7 m-80 . . . . . 0 C--O 1.252 1.221 0 CA-C-O 115.936 -1.983 . . . . 0.0 114.86 -179.329 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.471 0.585 0 N-CA-C 104.169 -2.53 . . . . 0.0 104.169 . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 8.5 p-10 -170.22 -174.01 1.63 Allowed 'General case' 0 C--N 1.322 -0.613 0 C-N-CA 129.398 3.079 . . . . 0.0 104.95 -177.498 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' SER . . . . . 0.452 ' HB2' HG12 ' A' ' 5' ' ' VAL . 58.9 p -144.3 118.37 9.45 Favored 'General case' 0 N--CA 1.449 -0.524 0 N-CA-C 108.422 -0.955 . . . . 0.0 108.422 178.642 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -64.0 -14.87 57.35 Favored 'General case' 0 CA--C 1.539 0.52 0 O-C-N 121.107 -0.996 . . . . 0.0 111.317 178.952 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.452 HG12 ' HB2' ' A' ' 3' ' ' SER . 6.8 p -64.75 -17.64 21.94 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.547 0 C-N-CA 125.856 1.662 . . . . 0.0 113.507 179.531 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 23.0 mmm180 -65.4 167.51 8.52 Favored 'General case' 0 CA--C 1.531 0.244 0 CA-C-O 121.964 0.888 . . . . 0.0 112.754 -178.727 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 40.7 ttmt -120.75 68.86 0.87 Allowed 'General case' 0 CA--C 1.529 0.141 0 C-N-CA 126.449 1.899 . . . . 0.0 107.926 179.683 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 58.6 tttp -66.56 -52.06 49.73 Favored 'General case' 0 C--O 1.235 0.317 0 O-C-N 121.51 -0.744 . . . . 0.0 111.244 -179.757 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 31.6 m -78.36 154.15 31.02 Favored 'General case' 0 N--CA 1.45 -0.467 0 CA-C-O 121.155 0.503 . . . . 0.0 110.753 -179.809 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -148.02 -6.9 0.43 Allowed 'General case' 0 C--N 1.328 -0.367 0 C-N-CA 125.651 1.58 . . . . 0.0 112.776 178.277 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 7.7 p -54.87 121.95 3.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 C-N-CA 127.228 2.211 . . . . 0.0 109.564 -179.675 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 25.6 ttp180 50.91 36.15 14.18 Favored 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 123.754 0.822 . . . . 0.0 111.158 179.829 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 30.7 mt-30 59.46 19.69 8.07 Favored 'General case' 0 N--CA 1.47 0.532 0 O-C-N 120.319 -1.488 . . . . 0.0 111.98 -178.41 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 22.1 pttt 44.25 38.82 2.61 Favored 'General case' 0 C--N 1.345 0.412 0 C-N-CA 128.269 2.628 . . . . 0.0 108.684 -178.109 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 15' ' ' THR . . . . . 0.407 ' HA ' ' O ' ' B' ' 22' ' ' PHE . 2.8 t -160.45 -166.51 1.67 Allowed 'General case' 0 N--CA 1.433 -1.283 0 C-N-CA 124.45 1.1 . . . . 0.0 109.079 -178.415 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 0.443 HG21 ' HB2' ' B' ' 27' ' ' ASP . 16.0 t -141.74 150.12 19.59 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.53 0 N-CA-C 104.08 -2.563 . . . . 0.0 104.08 178.161 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 14.6 p -145.19 113.94 1.52 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.491 0 N-CA-C 106.677 -1.601 . . . . 0.0 106.677 178.39 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 60.4 ttt-85 -147.83 161.94 40.25 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 106.783 -1.562 . . . . 0.0 106.783 179.465 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -92.99 133.55 36.02 Favored 'General case' 0 N--CA 1.442 -0.834 0 N-CA-C 104.688 -2.338 . . . . 0.0 104.688 178.056 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.536 HD13 ' H ' ' A' ' 21' ' ' ARG . 0.2 OUTLIER -115.6 159.33 21.44 Favored 'General case' 0 C--O 1.238 0.488 0 N-CA-C 105.673 -1.973 . . . . 0.0 105.673 178.34 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.536 ' H ' HD13 ' A' ' 20' ' ' LEU . 17.4 mmt85 -128.91 150.18 50.47 Favored 'General case' 0 CA--C 1.512 -0.505 0 C-N-CA 124.055 0.942 . . . . 0.0 109.565 -179.759 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 22' ' ' PHE . . . . . 0.464 ' O ' ' HA ' ' B' ' 15' ' ' THR . 90.0 m-85 -142.3 149.83 40.03 Favored 'General case' 0 CA--C 1.515 -0.379 0 N-CA-C 107.568 -1.271 . . . . 0.0 107.568 179.106 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 23' ' ' SER . . . . . 0.488 ' HB3' ' HD2' ' A' ' 24' ' ' PRO . 2.0 m -85.67 -175.62 0.65 Allowed Pre-proline 0 CA--C 1.55 0.965 0 C-N-CA 125.021 1.328 . . . . 0.0 111.091 -179.109 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 24' ' ' PRO . . . . . 0.488 ' HD2' ' HB3' ' A' ' 23' ' ' SER . 39.4 Cg_endo -65.7 -55.06 0.47 Allowed 'Trans proline' 0 C--N 1.357 1.004 0 CA-C-N 121.94 1.729 . . . . 0.0 110.879 -179.485 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 59.9 t -62.0 -40.8 88.61 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.291 0 C-N-CA 123.11 0.564 . . . . 0.0 110.393 -179.772 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -58.46 -50.94 71.92 Favored 'General case' 0 C--O 1.228 -0.051 0 CA-C-N 118.376 0.535 . . . . 0.0 111.597 -179.048 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -65.09 -46.0 82.91 Favored 'General case' 0 CA--C 1.51 -0.563 0 C-N-CA 122.724 0.41 . . . . 0.0 111.311 -179.958 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 39.8 tt0 -54.12 -52.69 60.24 Favored 'General case' 0 N--CA 1.445 -0.708 0 C-N-CA 124.366 1.066 . . . . 0.0 109.69 -179.862 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 22.6 m -63.37 -54.03 43.2 Favored 'General case' 0 N--CA 1.449 -0.493 0 C-N-CA 124.309 1.043 . . . . 0.0 111.034 -179.786 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 34.0 mt -55.55 -44.72 77.46 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.243 0 CA-C-N 118.399 0.545 . . . . 0.0 110.396 -179.331 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 70.1 ttt-85 -62.56 -45.26 93.75 Favored 'General case' 0 C--N 1.33 -0.281 0 C-N-CA 123.179 0.592 . . . . 0.0 110.478 -179.75 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 4.2 mptp? -62.52 -49.21 76.25 Favored 'General case' 0 CA--C 1.517 -0.298 0 C-N-CA 123.085 0.554 . . . . 0.0 109.979 -179.608 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 30.7 tptt -62.12 -50.92 69.97 Favored 'General case' 0 N--CA 1.448 -0.56 0 C-N-CA 122.72 0.408 . . . . 0.0 109.954 -179.331 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -57.0 -47.3 81.15 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 123.824 0.85 . . . . 0.0 111.942 -178.721 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 19.9 tt0 -68.71 -22.46 64.35 Favored 'General case' 0 C--O 1.236 0.394 0 O-C-N 121.147 -0.971 . . . . 0.0 111.018 -179.391 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 24.0 t0 -87.9 -35.73 17.54 Favored 'General case' 0 CA--C 1.522 -0.106 0 C-N-CA 123.635 0.774 . . . . 0.0 110.452 -179.574 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 3.8 t -85.96 -11.43 53.08 Favored 'General case' 0 CA--C 1.536 0.416 0 O-C-N 121.351 -0.843 . . . . 0.0 110.345 179.088 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 86.44 -14.59 54.39 Favored Glycine 0 CA--C 1.527 0.82 0 C-N-CA 125.664 1.602 . . . . 0.0 112.453 -179.669 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 72.2 mt -75.31 112.06 11.21 Favored 'General case' 0 CA--C 1.506 -0.729 0 N-CA-C 105.098 -2.186 . . . . 0.0 105.098 -179.616 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 1.7 t -49.21 152.57 1.15 Allowed 'General case' 0 CA--C 1.538 0.505 0 N-CA-C 108.448 -0.945 . . . . 0.0 108.448 178.645 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 24.3 t -46.5 -35.57 2.61 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.418 0 C-N-CA 125.448 1.499 . . . . 0.0 112.063 -179.326 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -70.84 -47.82 57.27 Favored 'General case' 0 CA--C 1.539 0.535 0 O-C-N 121.337 -0.852 . . . . 0.0 110.325 178.058 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -61.75 -43.3 99.12 Favored 'General case' 0 C--O 1.224 -0.243 0 C-N-CA 124.73 1.212 . . . . 0.0 110.126 179.131 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 61.7 t80 -54.41 -52.89 60.32 Favored 'General case' 0 N--CA 1.449 -0.511 0 C-N-CA 125.247 1.419 . . . . 0.0 109.289 179.658 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.461 HG23 HG23 ' B' ' 45' ' ' ILE . 20.8 mm -56.55 -60.15 2.22 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.209 0 C-N-CA 123.306 0.642 . . . . 0.0 112.439 179.657 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 11.8 ptm180 -57.27 -44.45 83.96 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-N 118.277 0.49 . . . . 0.0 111.3 -178.775 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 22.8 t30 -57.91 -53.7 55.23 Favored 'General case' 0 N--CA 1.455 -0.221 0 C-N-CA 123.722 0.809 . . . . 0.0 112.019 -179.508 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -62.45 -34.16 76.25 Favored 'General case' 0 C--N 1.334 -0.074 0 N-CA-C 113.017 0.747 . . . . 0.0 113.017 -179.435 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -70.7 -41.82 71.47 Favored 'General case' 0 N--CA 1.448 -0.525 0 N-CA-C 111.971 0.36 . . . . 0.0 111.971 -178.719 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 17.6 mt -74.58 -40.96 61.3 Favored 'General case' 0 CA--C 1.513 -0.452 0 C-N-CA 123.028 0.531 . . . . 0.0 112.098 -178.623 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 43.8 m-80 . . . . . 0 C--O 1.252 1.221 0 O-C-N 124.194 0.934 . . . . 0.0 108.621 179.765 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 1' ' ' SER . . . . . . . . . . . . . 1.4 t . . . . . 0 N--CA 1.474 0.757 0 N-CA-C 101.935 -3.357 . . . . 0.0 101.935 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 2' ' ' ASP . . . . . . . . . . . . . 6.0 p-10 -170.41 -166.0 0.49 Allowed 'General case' 0 N--CA 1.444 -0.746 0 C-N-CA 126.584 1.954 . . . . 0.0 106.216 -174.949 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 3' ' ' SER . . . . . . . . . . . . . 8.4 m -138.91 172.18 13.23 Favored 'General case' 0 C--N 1.33 -0.268 0 C-N-CA 124.524 1.13 . . . . 0.0 108.934 -179.885 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 4' ' ' ALA . . . . . . . . . . . . . . . -109.31 -3.87 16.85 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 125.151 1.38 . . . . 0.0 112.023 179.979 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 17.1 t -76.02 -28.34 18.79 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.601 0 C-N-CA 124.13 0.972 . . . . 0.0 112.252 -179.171 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 6' ' ' ARG . . . . . . . . . . . . . 26.2 mmm180 -71.7 154.22 41.51 Favored 'General case' 0 C--O 1.237 0.415 0 O-C-N 120.239 -1.538 . . . . 0.0 110.194 -179.376 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 34.5 mtmt -110.81 160.05 17.1 Favored 'General case' 0 C--N 1.329 -0.317 0 C-N-CA 124.711 1.204 . . . . 0.0 107.902 179.117 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 62.4 tttp -138.32 -70.65 0.43 Allowed 'General case' 0 C--O 1.232 0.183 0 C-N-CA 124.031 0.933 . . . . 0.0 108.875 179.714 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 39.2 m -66.34 120.14 12.78 Favored 'General case' 0 N--CA 1.454 -0.265 0 C-N-CA 123.925 0.89 . . . . 0.0 110.152 179.23 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 10' ' ' GLU . . . . . 0.415 ' CD ' ' H ' ' B' ' 10' ' ' GLU . 0.0 OUTLIER -115.4 -8.73 12.21 Favored 'General case' 0 C--O 1.236 0.376 0 C-N-CA 127.636 2.374 . . . . 0.0 113.079 179.58 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 11' ' ' VAL . . . . . . . . . . . . . 79.6 t -58.91 135.13 23.68 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 N-CA-C 105.506 -2.035 . . . . 0.0 105.506 179.14 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 12' ' ' ARG . . . . . . . . . . . . . 7.2 ptp180 47.88 24.05 0.54 Allowed 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 125.714 1.606 . . . . 0.0 113.492 -179.477 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 13' ' ' GLN . . . . . . . . . . . . . 39.7 mt-30 61.01 25.88 15.88 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-N 120.607 1.549 . . . . 0.0 110.302 -177.64 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 56.4 pttt 46.08 33.15 1.6 Allowed 'General case' 0 C--N 1.349 0.551 0 C-N-CA 126.795 2.038 . . . . 0.0 109.144 -178.221 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 15' ' ' THR . . . . . 0.464 ' HA ' ' O ' ' A' ' 22' ' ' PHE . 6.9 t -154.43 -171.92 4.03 Favored 'General case' 0 N--CA 1.432 -1.327 0 CA-C-O 121.845 0.831 . . . . 0.0 111.077 -177.55 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 36.1 t -136.67 145.11 30.83 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.426 0 N-CA-C 104.225 -2.509 . . . . 0.0 104.225 178.856 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 12.3 p -130.93 112.57 22.37 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.697 0 N-CA-C 104.938 -2.245 . . . . 0.0 104.938 178.923 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 4.4 ttt-85 -142.84 146.75 34.44 Favored 'General case' 0 CA--C 1.51 -0.584 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.804 -179.646 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 87.4 m -93.34 117.96 30.71 Favored 'General case' 0 C--O 1.239 0.514 0 N-CA-C 104.715 -2.328 . . . . 0.0 104.715 178.391 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 14.6 tp -120.38 138.54 53.69 Favored 'General case' 0 C--O 1.236 0.395 0 C-N-CA 124.434 1.094 . . . . 0.0 108.869 -178.742 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 11.2 mtt85 -116.15 161.32 19.11 Favored 'General case' 0 CA--C 1.519 -0.24 0 C-N-CA 124.142 0.977 . . . . 0.0 111.562 -179.177 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 22' ' ' PHE . . . . . 0.407 ' O ' ' HA ' ' A' ' 15' ' ' THR . 82.1 m-85 -143.83 157.64 44.23 Favored 'General case' 0 C--N 1.33 -0.258 0 C-N-CA 125.298 1.439 . . . . 0.0 108.019 -179.839 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 50.3 m -79.94 170.44 15.84 Favored Pre-proline 0 CA--C 1.548 0.89 0 C-N-CA 125.241 1.416 . . . . 0.0 107.369 178.344 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 24' ' ' PRO . . . . . . . . . . . . . 60.8 Cg_endo -69.12 -42.82 3.68 Favored 'Trans proline' 0 C--N 1.347 0.448 0 CA-C-N 121.345 1.516 . . . . 0.0 111.063 -178.868 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 25' ' ' VAL . . . . . . . . . . . . . 4.2 t -60.84 -39.16 80.97 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.475 0 C-N-CA 124.013 0.925 . . . . 0.0 108.916 179.762 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 81.3 mt-10 -69.46 -49.78 51.75 Favored 'General case' 0 C--O 1.22 -0.497 0 C-N-CA 123.55 0.74 . . . . 0.0 109.783 179.685 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 27' ' ' ASP . . . . . 0.443 ' HB2' HG21 ' A' ' 16' ' ' VAL . 2.6 t70 -56.09 -43.29 77.9 Favored 'General case' 0 CA--C 1.513 -0.448 0 C-N-CA 124.559 1.144 . . . . 0.0 111.477 179.635 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 28' ' ' GLU . . . . . . . . . . . . . 34.8 tt0 -65.09 -50.44 66.1 Favored 'General case' 0 N--CA 1.445 -0.724 0 O-C-N 123.927 0.767 . . . . 0.0 108.946 179.773 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 60.5 m -58.68 -51.78 68.48 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 122.979 0.512 . . . . 0.0 109.66 179.692 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 83.9 mt -58.45 -43.8 87.5 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.23 0 C-N-CA 124.337 1.055 . . . . 0.0 109.546 -179.803 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 64.9 ttt180 -62.82 -49.57 74.41 Favored 'General case' 0 CA--C 1.519 -0.223 0 O-C-N 121.587 -0.695 . . . . 0.0 110.005 179.737 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 5.1 mptp? -62.28 -42.99 99.82 Favored 'General case' 0 N--CA 1.454 -0.242 0 CA-C-O 118.044 -0.979 . . . . 0.0 110.408 -179.741 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 33' ' ' LYS . . . . . 0.433 ' HD2' ' HA ' ' B' ' 33' ' ' LYS . 34.7 tptt -70.37 -37.74 74.63 Favored 'General case' 0 CA--C 1.521 -0.135 0 CA-C-N 119.715 1.143 . . . . 0.0 111.369 -179.413 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 34' ' ' ALA . . . . . . . . . . . . . . . -60.82 -49.12 78.76 Favored 'General case' 0 N--CA 1.453 -0.303 0 N-CA-C 107.259 -1.385 . . . . 0.0 107.259 177.999 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 67.9 tt0 -60.7 -44.64 96.32 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 124.233 1.013 . . . . 0.0 110.863 179.85 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 36' ' ' ASP . . . . . . . . . . . . . 20.8 t70 -62.19 -41.73 98.61 Favored 'General case' 0 CA--C 1.519 -0.214 0 C-N-CA 126.781 2.033 . . . . 0.0 110.19 -179.436 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 37' ' ' SER . . . . . . . . . . . . . 8.0 t -82.16 -10.44 59.17 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 123.058 0.543 . . . . 0.0 111.159 179.527 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 71.41 10.95 71.24 Favored Glycine 0 CA--C 1.533 1.17 0 O-C-N 120.776 -1.203 . . . . 0.0 111.302 -178.761 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 39' ' ' LEU . . . . . . . . . . . . . 27.2 mt -107.07 112.63 25.64 Favored 'General case' 0 N--CA 1.451 -0.399 0 C-N-CA 126.486 1.914 . . . . 0.0 106.173 -179.93 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 40' ' ' THR . . . . . . . . . . . . . 6.4 t -45.51 153.78 0.23 Allowed 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 125.957 1.703 . . . . 0.0 110.156 179.476 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 41' ' ' VAL . . . . . . . . . . . . . 89.4 t -45.62 -45.41 4.49 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.246 0 C-N-CA 124.621 1.168 . . . . 0.0 111.686 -178.683 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 42' ' ' SER . . . . . . . . . . . . . 4.3 p -63.64 -42.92 98.09 Favored 'General case' 0 CA--C 1.541 0.628 0 O-C-N 121.117 -0.989 . . . . 0.0 112.063 179.597 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -65.26 -43.42 91.36 Favored 'General case' 0 C--N 1.34 0.157 0 C-N-CA 125.03 1.332 . . . . 0.0 109.193 178.956 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 44' ' ' TYR . . . . . . . . . . . . . 84.8 t80 -58.1 -52.28 66.21 Favored 'General case' 0 N--CA 1.448 -0.527 0 C-N-CA 125.26 1.424 . . . . 0.0 108.497 179.298 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 45' ' ' ILE . . . . . 0.461 HG23 HG23 ' A' ' 45' ' ' ILE . 16.8 mm -57.51 -62.61 0.87 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.393 0 C-N-CA 123.961 0.904 . . . . 0.0 111.261 179.81 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 46' ' ' ARG . . . . . . . . . . . . . 9.0 ptm180 -53.59 -41.17 66.31 Favored 'General case' 0 C--O 1.224 -0.287 0 CA-C-O 118.057 -0.973 . . . . 0.0 112.558 -178.664 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 47' ' ' ASN . . . . . . . . . . . . . 16.1 t30 -70.62 -52.2 22.96 Favored 'General case' 0 N--CA 1.453 -0.321 0 C-N-CA 124.502 1.121 . . . . 0.0 111.187 -179.348 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -58.4 -31.45 67.71 Favored 'General case' 0 CA--C 1.53 0.178 0 C-N-CA 122.908 0.483 . . . . 0.0 112.016 -179.175 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 49' ' ' ALA . . . . . . . . . . . . . . . -74.83 -21.05 59.5 Favored 'General case' 0 N--CA 1.445 -0.686 0 N-CA-C 114.761 1.393 . . . . 0.0 114.761 -179.476 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 10.8 mt -105.38 -34.84 7.71 Favored 'General case' 0 N--CA 1.469 0.52 0 N-CA-C 113.757 1.021 . . . . 0.0 113.757 -178.391 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 51' ' ' ASN . . . . . . . . . . . . . 26.3 m-80 . . . . . 0 C--O 1.252 1.232 0 CA-C-O 116.214 -1.85 . . . . 0.0 113.528 -178.307 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 1.4 p . . . . . 0 CA--C 1.51 -0.573 0 N-CA-C 103.662 -2.718 . . . . 0.0 103.662 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 12.0 t70 -74.58 160.68 30.55 Favored 'General case' 0 C--O 1.24 0.598 0 N-CA-C 105.519 -2.03 . . . . 0.0 105.519 176.182 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 70.1 m -143.0 93.83 2.55 Favored 'General case' 0 N--CA 1.443 -0.777 0 N-CA-C 104.16 -2.533 . . . . 0.0 104.16 179.109 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -53.47 -8.62 0.15 Allowed 'General case' 0 C--O 1.243 0.755 0 N-CA-C 116.452 2.019 . . . . 0.0 116.452 -178.834 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 11.3 p -62.37 141.69 17.54 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.346 0 N-CA-C 106.604 -1.628 . . . . 0.0 106.604 178.294 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -144.33 164.06 31.9 Favored 'General case' 0 C--O 1.236 0.386 0 O-C-N 120.517 -1.364 . . . . 0.0 110.961 -179.48 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -87.21 178.51 6.86 Favored 'General case' 0 C--O 1.237 0.431 0 N-CA-C 107.7 -1.222 . . . . 0.0 107.7 178.338 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 35.4 pttt -152.36 -178.9 7.1 Favored 'General case' 0 C--N 1.321 -0.649 0 C-N-CA 126.952 2.101 . . . . 0.0 105.652 178.551 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 50.3 p -132.18 135.09 46.09 Favored 'General case' 0 N--CA 1.442 -0.852 0 N-CA-C 105.348 -2.093 . . . . 0.0 105.348 178.67 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.7 pm0 -123.06 5.04 9.29 Favored 'General case' 0 C--N 1.323 -0.544 0 C-N-CA 124.874 1.27 . . . . 0.0 110.391 179.805 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.405 HG22 ' H ' ' A' ' 11' ' ' VAL . 1.3 m -71.43 -50.74 38.34 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.289 0 C-N-CA 126.319 1.847 . . . . 0.0 111.673 179.074 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 13.4 ttm180 -68.91 156.78 37.9 Favored 'General case' 0 C--O 1.236 0.373 0 C-N-CA 123.795 0.838 . . . . 0.0 111.443 -178.214 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 8.1 pt20 -87.87 66.51 8.76 Favored 'General case' 0 C--N 1.331 -0.197 0 N-CA-C 107.648 -1.242 . . . . 0.0 107.648 178.242 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 14.8 pttm -64.51 -41.4 96.43 Favored 'General case' 0 C--O 1.225 -0.204 0 N-CA-C 108.43 -0.952 . . . . 0.0 108.43 178.991 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 11.4 t -65.48 148.28 51.98 Favored 'General case' 0 N--CA 1.439 -1.025 0 N-CA-C 107.305 -1.369 . . . . 0.0 107.305 177.995 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 2.3 p -80.2 148.8 5.49 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.01 0 N-CA-C 105.515 -2.032 . . . . 0.0 105.515 178.245 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 13.1 p -144.81 114.0 1.68 Allowed 'Isoleucine or valine' 0 N--CA 1.441 -0.914 0 N-CA-C 107.541 -1.281 . . . . 0.0 107.541 177.692 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 17.0 ttt85 -145.47 177.72 8.64 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 106.57 -1.641 . . . . 0.0 106.57 178.951 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 29.5 m -128.35 139.69 52.25 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 104.346 -2.464 . . . . 0.0 104.346 179.156 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 77.8 mt -120.16 169.08 10.57 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-N 118.626 0.648 . . . . 0.0 109.764 179.605 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 12.3 mmt-85 -137.81 136.09 36.89 Favored 'General case' 0 C--O 1.237 0.397 0 C-N-CA 126.281 1.832 . . . . 0.0 109.38 -179.975 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 22' ' ' PHE . . . . . 0.41 ' H ' HG13 ' B' ' 16' ' ' VAL . 24.6 m-85 -133.95 152.58 51.91 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 106.715 -1.587 . . . . 0.0 106.715 178.76 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 4.9 m -69.04 166.93 23.43 Favored Pre-proline 0 CA--C 1.543 0.681 0 N-CA-C 107.734 -1.21 . . . . 0.0 107.734 178.929 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 19.5 Cg_endo -56.84 -48.62 17.66 Favored 'Trans proline' 0 N--CA 1.461 -0.425 0 C-N-CA 121.801 1.667 . . . . 0.0 112.21 -178.975 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 98.0 t -59.94 -43.67 92.81 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.471 0 C-N-CA 126.171 1.788 . . . . 0.0 110.722 179.861 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 88.0 mt-10 -67.39 -46.05 74.43 Favored 'General case' 0 C--N 1.334 -0.076 0 C-N-CA 124.991 1.316 . . . . 0.0 110.7 -178.827 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 30.5 t70 -62.4 -42.11 99.18 Favored 'General case' 0 CA--C 1.519 -0.213 0 N-CA-C 109.12 -0.696 . . . . 0.0 109.12 179.443 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 16.5 tt0 -66.28 -37.03 84.5 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 124.298 1.039 . . . . 0.0 109.79 178.883 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 95.3 m -64.35 -55.05 23.8 Favored 'General case' 0 CA--C 1.531 0.224 0 N-CA-C 106.949 -1.5 . . . . 0.0 106.949 178.68 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 75.1 mt -56.46 -45.68 81.95 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.247 0 C-N-CA 124.219 1.008 . . . . 0.0 108.987 -179.882 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 74.6 ttt180 -59.95 -47.54 85.38 Favored 'General case' 0 N--CA 1.457 -0.091 0 C-N-CA 123.511 0.724 . . . . 0.0 110.966 -179.785 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 11.7 mptt -64.02 -48.73 75.16 Favored 'General case' 0 CA--C 1.522 -0.109 0 CA-C-O 118.15 -0.928 . . . . 0.0 110.647 -179.792 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 24.9 mmtp -60.6 -46.12 91.42 Favored 'General case' 0 N--CA 1.463 0.213 0 CA-C-N 119.019 0.827 . . . . 0.0 109.915 -179.539 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -56.93 -55.28 36.63 Favored 'General case' 0 N--CA 1.454 -0.23 0 C-N-CA 124.013 0.925 . . . . 0.0 110.286 179.787 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 27.5 tt0 -64.43 -35.07 79.72 Favored 'General case' 0 N--CA 1.455 -0.21 0 CA-C-O 119.072 -0.49 . . . . 0.0 112.193 -178.761 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 41.8 t0 -66.21 -39.74 89.85 Favored 'General case' 0 N--CA 1.466 0.325 0 N-CA-C 107.838 -1.171 . . . . 0.0 107.838 179.484 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 22.9 t -75.57 -10.63 59.61 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 125.482 1.513 . . . . 0.0 110.211 178.374 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 73.06 4.15 62.3 Favored Glycine 0 CA--C 1.531 1.068 0 C-N-CA 125.551 1.548 . . . . 0.0 113.962 -179.984 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 12.9 mt -106.34 128.03 53.7 Favored 'General case' 0 CA--C 1.51 -0.584 0 N-CA-C 105.414 -2.069 . . . . 0.0 105.414 179.749 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 8.7 t -50.82 152.43 2.1 Favored 'General case' 0 CA--C 1.539 0.546 0 CA-C-O 121.435 0.636 . . . . 0.0 110.571 179.256 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 52.0 t -46.63 -40.49 4.55 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.166 0 C-N-CA 126.089 1.756 . . . . 0.0 111.908 -179.78 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 3.5 p -61.46 -42.58 99.0 Favored 'General case' 0 CA--C 1.535 0.365 0 CA-C-N 119.567 1.076 . . . . 0.0 111.37 -179.732 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -70.65 -42.13 71.23 Favored 'General case' 0 C--O 1.222 -0.391 0 N-CA-C 108.527 -0.916 . . . . 0.0 108.527 178.343 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 56.0 t80 -55.08 -51.5 66.19 Favored 'General case' 0 CA--C 1.535 0.396 0 CA-C-N 118.838 0.745 . . . . 0.0 109.083 179.235 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 18.1 mm -56.83 -61.44 1.23 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.19 0 C-N-CA 125.173 1.389 . . . . 0.0 110.207 179.686 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 11.8 ptt180 -51.58 -44.3 62.73 Favored 'General case' 0 C--O 1.222 -0.377 0 C-N-CA 123.655 0.782 . . . . 0.0 110.738 -179.135 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 2.2 t30 -62.07 -56.85 14.81 Favored 'General case' 0 N--CA 1.452 -0.338 0 C-N-CA 123.882 0.873 . . . . 0.0 110.031 179.016 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -59.12 -32.05 69.49 Favored 'General case' 0 C--O 1.224 -0.256 0 N-CA-C 113.521 0.934 . . . . 0.0 113.521 -178.645 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -76.28 -24.5 54.45 Favored 'General case' 0 CA--C 1.533 0.322 0 N-CA-C 113.696 0.999 . . . . 0.0 113.696 -179.485 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 17.9 mt -97.46 -28.3 14.05 Favored 'General case' 0 N--CA 1.466 0.339 0 C-N-CA 123.18 0.592 . . . . 0.0 110.288 179.62 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 43.1 m-80 . . . . . 0 C--O 1.253 1.276 0 C-N-CA 125.521 1.528 . . . . 0.0 108.335 179.133 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' B' B ' 1' ' ' SER . . . . . . . . . . . . . 1.5 p . . . . . 0 CA--C 1.51 -0.562 0 N-CA-C 103.874 -2.639 . . . . 0.0 103.874 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' B' B ' 2' ' ' ASP . . . . . . . . . . . . . 11.8 t70 -75.3 162.84 28.07 Favored 'General case' 0 C--O 1.241 0.638 0 N-CA-C 105.87 -1.9 . . . . 0.0 105.87 176.379 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 3' ' ' SER . . . . . . . . . . . . . 74.7 m -139.61 85.61 2.06 Favored 'General case' 0 N--CA 1.446 -0.643 0 N-CA-C 104.088 -2.56 . . . . 0.0 104.088 179.079 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 4' ' ' ALA . . . . . . . . . . . . . . . -62.33 76.3 0.02 OUTLIER 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 126.129 1.772 . . . . 0.0 113.832 -178.836 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 9.1 p -144.22 148.05 18.91 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.309 0 N-CA-C 105.635 -1.987 . . . . 0.0 105.635 178.733 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 6' ' ' ARG . . . . . . . . . . . . . 9.1 ptm180 -148.87 137.43 21.18 Favored 'General case' 0 C--O 1.236 0.359 0 O-C-N 120.568 -1.333 . . . . 0.0 110.313 -179.038 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.65 165.24 25.46 Favored 'General case' 0 C--O 1.236 0.387 0 N-CA-C 108.923 -0.769 . . . . 0.0 108.923 179.366 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 25.9 pttm -128.56 -177.4 4.16 Favored 'General case' 0 C--N 1.328 -0.35 0 C-N-CA 125.226 1.41 . . . . 0.0 110.046 179.871 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 3.3 p -120.11 85.7 2.43 Favored 'General case' 0 N--CA 1.454 -0.253 0 C-N-CA 124.683 1.193 . . . . 0.0 108.513 -179.802 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 10' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -70.87 -12.9 61.82 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 114.235 1.198 . . . . 0.0 114.235 -179.753 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 11' ' ' VAL . . . . . . . . . . . . . 31.6 t -78.09 -52.78 15.33 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 C-N-CA 124.243 1.017 . . . . 0.0 108.626 179.83 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 12' ' ' ARG . . . . . . . . . . . . . 15.9 ttm180 -59.35 138.62 57.57 Favored 'General case' 0 C--N 1.343 0.307 0 N-CA-C 109.048 -0.723 . . . . 0.0 109.048 -179.564 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 13' ' ' GLN . . . . . . . . . . . . . 20.4 pt20 -73.44 71.28 1.29 Allowed 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 125.221 1.409 . . . . 0.0 111.904 179.613 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 22.3 pttm -59.2 -31.14 68.75 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 123.509 0.723 . . . . 0.0 110.903 178.606 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 5.5 t -70.08 -167.71 0.17 Allowed 'General case' 0 N--CA 1.443 -0.8 0 C-N-CA 126.595 1.958 . . . . 0.0 110.711 179.157 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 16' ' ' VAL . . . . . 0.41 HG13 ' H ' ' A' ' 22' ' ' PHE . 0.3 OUTLIER -130.24 148.46 33.16 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.794 0 N-CA-C 102.209 -3.256 . . . . 0.0 102.209 178.316 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 9.3 p -147.08 98.79 0.41 Allowed 'Isoleucine or valine' 0 N--CA 1.436 -1.173 0 N-CA-C 104.559 -2.386 . . . . 0.0 104.559 179.201 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 16.8 ttt85 -138.74 152.37 47.91 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.105 -0.952 . . . . 0.0 110.945 -179.265 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 19.6 m -91.73 135.89 33.56 Favored 'General case' 0 C--N 1.326 -0.435 0 C-N-CA 125.316 1.446 . . . . 0.0 108.195 179.92 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 20' ' ' LEU . . . . . 0.403 HD23 ' CZ ' ' B' ' 22' ' ' PHE . 0.2 OUTLIER -139.09 134.82 33.43 Favored 'General case' 0 C--O 1.237 0.407 0 N-CA-C 108.84 -0.8 . . . . 0.0 108.84 179.085 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 50.1 mtm-85 -115.67 159.1 21.79 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 124.475 1.11 . . . . 0.0 110.798 179.363 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 22' ' ' PHE . . . . . 0.403 ' CZ ' HD23 ' B' ' 20' ' ' LEU . 31.9 m-85 -145.43 154.24 42.04 Favored 'General case' 0 C--O 1.238 0.45 0 C-N-CA 125.398 1.479 . . . . 0.0 108.18 179.98 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 15.4 m -67.85 168.01 14.55 Favored Pre-proline 0 CA--C 1.537 0.46 0 N-CA-C 108.568 -0.901 . . . . 0.0 108.568 178.82 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 24' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -63.09 -42.19 24.6 Favored 'Trans proline' 0 N--CA 1.457 -0.63 0 CA-C-N 120.291 1.14 . . . . 0.0 109.329 179.356 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 25' ' ' VAL . . . . . . . . . . . . . 75.6 t -57.07 -44.75 83.53 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.585 0 C-N-CA 123.797 0.839 . . . . 0.0 109.637 178.925 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 49.3 mt-10 -66.23 -52.19 50.23 Favored 'General case' 0 N--CA 1.454 -0.23 0 C-N-CA 124.355 1.062 . . . . 0.0 110.392 -179.785 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 27' ' ' ASP . . . . . . . . . . . . . 34.9 t70 -60.27 -39.81 88.16 Favored 'General case' 0 C--O 1.223 -0.295 0 C-N-CA 123.692 0.797 . . . . 0.0 111.471 -179.237 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 28' ' ' GLU . . . . . . . . . . . . . 79.6 mt-10 -63.92 -50.91 66.85 Favored 'General case' 0 N--CA 1.453 -0.311 0 N-CA-C 107.616 -1.253 . . . . 0.0 107.616 178.506 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 90.2 m -55.1 -58.96 5.53 Favored 'General case' 0 CA--C 1.531 0.219 0 N-CA-C 109.104 -0.702 . . . . 0.0 109.104 179.618 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 92.9 mt -55.06 -47.03 77.53 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.353 0 C-N-CA 124.29 1.036 . . . . 0.0 110.132 -179.286 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 61.7 ttt180 -58.9 -48.83 80.05 Favored 'General case' 0 CA--C 1.52 -0.207 0 CA-C-N 119.093 0.861 . . . . 0.0 110.542 -179.752 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 10.6 mptt -61.7 -49.18 77.49 Favored 'General case' 0 C--O 1.22 -0.466 0 CA-C-O 118.546 -0.74 . . . . 0.0 109.889 -179.248 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 22.8 mmtp -56.71 -49.79 74.1 Favored 'General case' 0 CA--C 1.517 -0.319 0 C-N-CA 124.32 1.048 . . . . 0.0 109.574 -178.664 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 34' ' ' ALA . . . . . . . . . . . . . . . -56.19 -58.58 7.36 Favored 'General case' 0 N--CA 1.446 -0.646 0 C-N-CA 125.858 1.663 . . . . 0.0 110.5 179.967 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 11.6 tt0 -67.38 -20.21 65.52 Favored 'General case' 0 N--CA 1.467 0.391 0 N-CA-C 113.599 0.963 . . . . 0.0 113.599 -177.796 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 36' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -92.15 2.96 56.27 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 126.401 1.88 . . . . 0.0 110.7 178.884 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 37' ' ' SER . . . . . . . . . . . . . 18.6 t -122.59 -6.35 8.65 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 125.779 1.632 . . . . 0.0 111.021 -179.921 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 73.87 31.5 60.07 Favored Glycine 0 CA--C 1.527 0.783 0 N-CA-C 110.176 -1.169 . . . . 0.0 110.176 -179.455 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 39' ' ' LEU . . . . . . . . . . . . . 59.6 mt -128.19 129.56 46.66 Favored 'General case' 0 N--CA 1.446 -0.637 0 C-N-CA 125.959 1.704 . . . . 0.0 108.83 -178.491 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 40' ' ' THR . . . . . . . . . . . . . 1.8 t -66.59 152.4 45.37 Favored 'General case' 0 CA--C 1.541 0.611 0 N-CA-C 104.344 -2.465 . . . . 0.0 104.344 176.626 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 41' ' ' VAL . . . . . . . . . . . . . 55.0 t -47.58 -40.94 7.6 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.338 0 C-N-CA 124.596 1.158 . . . . 0.0 111.118 179.157 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 42' ' ' SER . . . . . . . . . . . . . 5.1 p -61.77 -44.21 97.33 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-N 120.007 1.276 . . . . 0.0 111.08 179.598 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -65.76 -40.53 92.13 Favored 'General case' 0 C--O 1.226 -0.18 0 C-N-CA 124.008 0.923 . . . . 0.0 109.059 178.776 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 44' ' ' TYR . . . . . . . . . . . . . 53.4 t80 -60.64 -52.64 64.28 Favored 'General case' 0 CA--C 1.534 0.35 0 N-CA-C 108.114 -1.069 . . . . 0.0 108.114 178.904 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 45' ' ' ILE . . . . . . . . . . . . . 23.2 mm -54.53 -62.19 0.8 Allowed 'Isoleucine or valine' 0 C--N 1.34 0.169 0 C-N-CA 124.537 1.135 . . . . 0.0 110.672 -179.888 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 46' ' ' ARG . . . . . . . . . . . . . 22.2 ptt180 -54.75 -47.03 74.34 Favored 'General case' 0 C--O 1.223 -0.291 0 CA-C-O 119.302 -0.38 . . . . 0.0 111.711 -178.856 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 47' ' ' ASN . . . . . . . . . . . . . 23.7 t30 -61.08 -52.04 66.62 Favored 'General case' 0 N--CA 1.448 -0.528 0 CA-C-O 118.282 -0.866 . . . . 0.0 111.132 -178.814 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -63.42 -27.86 69.58 Favored 'General case' 0 C--O 1.225 -0.223 0 C-N-CA 124.038 0.935 . . . . 0.0 112.075 179.776 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 49' ' ' ALA . . . . . . . . . . . . . . . -77.75 -34.8 52.29 Favored 'General case' 0 N--CA 1.457 -0.082 0 O-C-N 121.391 -0.818 . . . . 0.0 111.692 -179.914 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 38.1 mt -82.51 -46.16 13.77 Favored 'General case' 0 C--N 1.33 -0.249 0 C-N-CA 122.874 0.469 . . . . 0.0 110.629 -179.06 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 51' ' ' ASN . . . . . . . . . . . . . 42.5 m-80 . . . . . 0 C--O 1.248 0.981 0 C-N-CA 124.768 1.227 . . . . 0.0 110.668 -179.721 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 24.5 m . . . . . 0 N--CA 1.477 0.894 0 CA-C-O 121.499 0.666 . . . . 0.0 111.378 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -45.08 22.83 0.0 OUTLIER 'General case' 0 CA--C 1.538 0.498 1 C-N-CA 142.357 8.263 . . . . 0.0 115.89 -179.49 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 23.3 p -66.24 61.52 0.04 OUTLIER 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 129.754 3.222 . . . . 0.0 112.87 -179.725 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -55.92 -18.65 9.57 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 125.87 1.668 . . . . 0.0 115.355 -179.129 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 14.5 p -51.02 -32.71 12.28 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.45 0 C-N-CA 125.4 1.48 . . . . 0.0 114.563 -179.255 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 48.9 ttp180 -139.57 127.19 21.75 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 119.513 1.051 . . . . 0.0 110.077 -179.41 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 72.3 mttt -68.98 -67.03 0.5 Allowed 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 123.39 0.676 . . . . 0.0 109.794 179.277 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 37.6 mtpt -140.94 179.83 6.49 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 125.005 1.322 . . . . 0.0 108.631 179.391 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 5.1 t -141.5 117.5 10.56 Favored 'General case' 0 N--CA 1.453 -0.311 0 N-CA-C 106.209 -1.775 . . . . 0.0 106.209 179.461 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 13.3 pt-20 -117.68 1.77 12.23 Favored 'General case' 0 N--CA 1.473 0.715 0 N-CA-C 113.522 0.934 . . . . 0.0 113.522 -179.438 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 11.9 m -63.64 136.04 26.81 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.331 0 C-N-CA 124.126 0.97 . . . . 0.0 109.859 179.678 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 4.3 mmp_? -89.0 -32.86 17.4 Favored 'General case' 0 CA--C 1.517 -0.296 0 N-CA-C 113.189 0.811 . . . . 0.0 113.189 -178.98 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 82.5 mt-30 -76.41 96.79 4.11 Favored 'General case' 0 N--CA 1.454 -0.246 0 CA-C-O 121.651 0.738 . . . . 0.0 110.217 -178.885 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 21.2 ptmt -66.36 -33.1 74.96 Favored 'General case' 0 N--CA 1.462 0.159 0 N-CA-C 109.591 -0.522 . . . . 0.0 109.591 178.825 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 4.2 t -78.99 168.04 20.25 Favored 'General case' 0 N--CA 1.44 -0.941 0 C-N-CA 124.84 1.256 . . . . 0.0 108.793 179.306 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 95.2 t -97.86 145.34 9.66 Favored 'Isoleucine or valine' 0 CA--C 1.505 -0.755 0 C-N-CA 126.747 2.019 . . . . 0.0 105.918 179.308 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 7.8 p -145.62 99.95 0.51 Allowed 'Isoleucine or valine' 0 N--CA 1.441 -0.908 0 CA-C-O 122.6 1.191 . . . . 0.0 108.484 178.066 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 26.4 mtt-85 -143.12 157.39 44.56 Favored 'General case' 0 CA--C 1.511 -0.531 0 CA-C-N 115.084 -0.962 . . . . 0.0 110.234 178.824 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 96.6 m -86.42 100.5 12.39 Favored 'General case' 0 N--CA 1.446 -0.671 0 N-CA-C 106.664 -1.606 . . . . 0.0 106.664 179.548 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -95.4 86.68 4.57 Favored 'General case' 0 C--N 1.323 -0.579 0 C-N-CA 126.806 2.042 . . . . 0.0 107.321 -179.27 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 14.0 mtp180 -77.36 162.51 27.21 Favored 'General case' 0 N--CA 1.453 -0.316 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.64 179.246 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 92.7 m-85 -139.8 171.08 14.73 Favored 'General case' 0 CA--C 1.516 -0.349 0 C-N-CA 125.966 1.707 . . . . 0.0 108.068 178.985 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 7.7 m -106.2 172.56 3.83 Favored Pre-proline 0 CA--C 1.547 0.848 0 N-CA-C 108.063 -1.088 . . . . 0.0 108.063 179.306 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 92.5 Cg_endo -70.67 -33.99 12.27 Favored 'Trans proline' 0 N--CA 1.46 -0.482 0 CA-C-N 122.163 1.808 . . . . 0.0 113.341 -177.545 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 35.7 t -77.31 -36.3 23.77 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.31 0 N-CA-C 107.209 -1.404 . . . . 0.0 107.209 179.187 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 73.9 mt-10 -61.28 -54.1 48.35 Favored 'General case' 0 C--N 1.343 0.285 0 N-CA-C 107.523 -1.288 . . . . 0.0 107.523 178.709 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -57.34 -46.53 83.2 Favored 'General case' 0 C--O 1.217 -0.623 0 C-N-CA 125.068 1.347 . . . . 0.0 111.181 -179.838 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 13.3 tt0 -58.37 -51.38 70.07 Favored 'General case' 0 N--CA 1.452 -0.33 0 CA-C-O 118.726 -0.654 . . . . 0.0 111.204 179.745 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 85.5 m -57.33 -52.5 65.12 Favored 'General case' 0 CA--C 1.536 0.423 0 CA-C-N 118.766 0.712 . . . . 0.0 109.52 179.454 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 96.0 mt -56.89 -47.53 82.94 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.178 0 C-N-CA 123.392 0.677 . . . . 0.0 110.356 -179.299 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 33.1 ttt85 -61.78 -44.83 96.12 Favored 'General case' 0 N--CA 1.448 -0.545 0 C-N-CA 123.875 0.87 . . . . 0.0 111.769 -179.082 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 14.0 mptt -59.17 -51.22 70.95 Favored 'General case' 0 CA--C 1.516 -0.33 0 CA-C-N 118.549 0.613 . . . . 0.0 109.649 179.469 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 4.6 mptp? -62.9 -47.18 84.4 Favored 'General case' 0 CA--C 1.515 -0.379 0 CA-C-O 118.135 -0.936 . . . . 0.0 110.637 -179.01 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -56.15 -55.48 32.6 Favored 'General case' 0 N--CA 1.451 -0.391 0 C-N-CA 124.217 1.007 . . . . 0.0 109.776 179.505 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 5.3 tt0 -60.25 -38.65 84.13 Favored 'General case' 0 C--O 1.234 0.241 0 O-C-N 123.54 0.525 . . . . 0.0 111.545 -178.113 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -72.08 -24.93 61.58 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 123.872 0.869 . . . . 0.0 111.196 179.458 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 2.2 t -83.52 -8.15 59.4 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 126.477 1.911 . . . . 0.0 109.023 178.129 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 77.88 8.66 87.27 Favored Glycine 0 CA--C 1.529 0.957 0 CA-C-O 118.812 -0.994 . . . . 0.0 111.716 -179.029 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 40.1 mt -116.55 154.98 29.47 Favored 'General case' 0 N--CA 1.452 -0.344 0 CA-C-N 119.758 1.779 . . . . 0.0 111.457 -178.435 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 40' ' ' THR . . . . . 0.433 HG22 ' H ' ' A' ' 40' ' ' THR . 0.9 OUTLIER -74.99 151.61 38.78 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 104.116 -2.549 . . . . 0.0 104.116 176.159 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 19.4 m -51.2 -31.29 11.06 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.929 0 CA-C-N 114.873 -1.058 . . . . 0.0 110.937 178.93 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 29.3 t -61.0 -58.94 6.32 Favored 'General case' 0 CA--C 1.536 0.435 0 CA-C-N 119.421 1.009 . . . . 0.0 108.936 178.549 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -58.98 -39.52 82.02 Favored 'General case' 0 C--O 1.223 -0.3 0 C-N-CA 123.662 0.785 . . . . 0.0 109.385 178.78 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 77.8 t80 -60.78 -50.19 74.45 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-O 119.084 -0.484 . . . . 0.0 109.737 179.059 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 10.8 mm -55.6 -62.96 0.66 Allowed 'Isoleucine or valine' 0 N--CA 1.463 0.182 0 C-N-CA 125.272 1.429 . . . . 0.0 109.904 179.99 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 27.3 ptt180 -53.08 -44.09 67.28 Favored 'General case' 0 N--CA 1.454 -0.271 0 C-N-CA 123.293 0.637 . . . . 0.0 110.708 -178.579 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 39.1 t30 -63.2 -55.98 20.5 Favored 'General case' 0 N--CA 1.45 -0.444 0 C-N-CA 123.502 0.721 . . . . 0.0 111.583 -179.798 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -61.35 -28.35 69.16 Favored 'General case' 0 N--CA 1.463 0.223 0 C-N-CA 123.965 0.906 . . . . 0.0 112.096 -178.91 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -74.93 -27.62 60.28 Favored 'General case' 0 N--CA 1.453 -0.281 0 N-CA-C 113.022 0.749 . . . . 0.0 113.022 -179.468 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 13.7 mt -93.83 -44.64 8.02 Favored 'General case' 0 C--N 1.332 -0.193 0 C-N-CA 122.849 0.46 . . . . 0.0 110.747 -179.378 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 79.1 m-20 . . . . . 0 C--O 1.244 0.789 0 C-N-CA 124.622 1.169 . . . . 0.0 111.249 -178.229 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B ' 1' ' ' SER . . . . . . . . . . . . . 20.4 m . . . . . 0 N--CA 1.478 0.958 0 CA-C-O 121.758 0.79 . . . . 0.0 111.46 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B ' 2' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -46.45 31.73 0.0 OUTLIER 'General case' 0 CA--C 1.536 0.414 1 C-N-CA 142.201 8.2 . . . . 0.0 114.608 -179.657 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 3' ' ' SER . . . . . . . . . . . . . 16.8 p -67.27 63.62 0.06 Allowed 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 128.924 2.89 . . . . 0.0 114.121 -178.89 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 4' ' ' ALA . . . . . . . . . . . . . . . -58.19 -18.36 25.36 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 124.449 1.099 . . . . 0.0 112.481 179.356 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 4.5 m -55.35 -28.0 21.36 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.412 0 C-N-CA 126.916 2.086 . . . . 0.0 114.178 179.625 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 6' ' ' ARG . . . . . . . . . . . . . 58.9 ttp180 -149.81 130.86 14.39 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-N 120.94 1.7 . . . . 0.0 110.127 -179.448 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 59.3 mttt -74.17 -63.32 1.25 Allowed 'General case' 0 N--CA 1.465 0.305 0 CA-C-O 118.242 -0.885 . . . . 0.0 111.3 179.98 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 23.5 mtpt -144.3 -178.28 5.89 Favored 'General case' 0 N--CA 1.471 0.601 0 CA-C-N 120.324 1.42 . . . . 0.0 109.565 179.775 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -151.94 113.7 4.4 Favored 'General case' 0 N--CA 1.454 -0.251 0 N-CA-C 105.202 -2.147 . . . . 0.0 105.202 178.31 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 10' ' ' GLU . . . . . . . . . . . . . 14.0 pt-20 -111.49 18.21 19.34 Favored 'General case' 0 C--O 1.236 0.366 0 C-N-CA 124.418 1.087 . . . . 0.0 112.769 -178.719 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 11' ' ' VAL . . . . . . . . . . . . . 9.7 m -60.99 154.61 4.45 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.303 0 C-N-CA 124.929 1.291 . . . . 0.0 110.14 179.134 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 12' ' ' ARG . . . . . . . . . . . . . 4.9 ptm180 -130.47 6.45 4.82 Favored 'General case' 0 N--CA 1.466 0.366 0 C-N-CA 123.417 0.687 . . . . 0.0 112.474 179.819 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 13' ' ' GLN . . . . . . . . . . . . . 71.7 mt-30 -122.39 91.51 3.52 Favored 'General case' 0 N--CA 1.45 -0.469 0 N-CA-C 106.598 -1.63 . . . . 0.0 106.598 179.357 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 20.1 ptmt -63.26 -25.79 68.48 Favored 'General case' 0 CA--C 1.531 0.25 0 O-C-N 122.173 -0.33 . . . . 0.0 111.069 179.369 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 3.4 t -72.62 176.45 5.47 Favored 'General case' 0 N--CA 1.451 -0.378 0 N-CA-C 108.567 -0.901 . . . . 0.0 108.567 178.518 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 12.1 t -128.46 115.82 39.29 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.663 0 N-CA-C 103.944 -2.613 . . . . 0.0 103.944 178.954 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 9.0 p -116.74 107.14 21.69 Favored 'Isoleucine or valine' 0 C--O 1.237 0.396 0 CA-C-O 121.957 0.884 . . . . 0.0 110.819 -178.898 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 36.4 mtt180 -133.64 -175.7 3.91 Favored 'General case' 0 C--O 1.239 0.525 0 N-CA-C 108.622 -0.881 . . . . 0.0 108.622 178.189 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 1.9 m -122.34 105.91 10.61 Favored 'General case' 0 N--CA 1.448 -0.555 0 N-CA-C 102.155 -3.276 . . . . 0.0 102.155 178.621 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 15.5 tp -112.27 89.74 3.15 Favored 'General case' 0 N--CA 1.442 -0.836 0 C-N-CA 125.241 1.416 . . . . 0.0 110.454 -177.975 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -63.38 157.42 23.18 Favored 'General case' 0 N--CA 1.452 -0.347 0 C-N-CA 124.614 1.166 . . . . 0.0 110.125 178.177 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 22' ' ' PHE . . . . . . . . . . . . . 88.2 m-85 -138.65 143.63 39.32 Favored 'General case' 0 C--O 1.236 0.389 0 N-CA-C 103.915 -2.624 . . . . 0.0 103.915 177.198 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 23' ' ' SER . . . . . 0.407 ' HB3' ' HD2' ' B' ' 24' ' ' PRO . 3.3 m -73.88 169.41 18.94 Favored Pre-proline 0 C--N 1.32 -0.692 0 C-N-CA 124.204 1.002 . . . . 0.0 109.535 -179.144 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 24' ' ' PRO . . . . . 0.407 ' HD2' ' HB3' ' B' ' 23' ' ' SER . 33.9 Cg_endo -63.25 -43.61 17.93 Favored 'Trans proline' 0 N--CA 1.46 -0.493 0 C-N-CA 121.401 1.401 . . . . 0.0 111.277 -179.371 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 25' ' ' VAL . . . . . . . . . . . . . 24.6 t -66.68 -39.91 84.88 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.298 0 C-N-CA 124.575 1.15 . . . . 0.0 110.313 -179.92 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 83.7 mt-10 -67.13 -44.25 80.34 Favored 'General case' 0 C--N 1.339 0.115 0 N-CA-C 109.359 -0.608 . . . . 0.0 109.359 -179.854 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 27' ' ' ASP . . . . . . . . . . . . . 28.9 t70 -61.3 -44.86 96.51 Favored 'General case' 0 C--O 1.214 -0.783 0 C-N-CA 123.739 0.815 . . . . 0.0 109.131 179.305 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 28' ' ' GLU . . . . . . . . . . . . . 72.7 tt0 -57.64 -52.91 63.51 Favored 'General case' 0 N--CA 1.445 -0.698 0 C-N-CA 125.019 1.328 . . . . 0.0 108.892 178.398 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 96.2 m -60.49 -53.39 58.1 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-N 120.343 1.429 . . . . 0.0 110.36 179.316 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 50.4 mt -55.3 -49.98 68.43 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.272 0 C-N-CA 123.099 0.559 . . . . 0.0 109.761 -179.513 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 31.8 ttt85 -62.09 -43.4 98.92 Favored 'General case' 0 CA--C 1.51 -0.593 0 CA-C-O 117.425 -1.274 . . . . 0.0 110.908 -179.17 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 9.7 mptt -61.11 -48.81 79.95 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 119.85 1.205 . . . . 0.0 109.164 -179.828 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -63.61 -49.34 73.69 Favored 'General case' 0 N--CA 1.455 -0.186 0 CA-C-N 117.988 0.358 . . . . 0.0 110.183 -179.133 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 34' ' ' ALA . . . . . . . . . . . . . . . -56.3 -57.04 13.96 Favored 'General case' 0 N--CA 1.452 -0.326 0 C-N-CA 126.41 1.884 . . . . 0.0 111.069 179.866 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 59.8 tt0 -60.94 -42.65 98.61 Favored 'General case' 0 C--O 1.233 0.202 0 C-N-CA 125.181 1.392 . . . . 0.0 111.286 -178.454 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 36' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -65.52 -40.86 93.44 Favored 'General case' 0 C--N 1.333 -0.134 0 C-N-CA 123.604 0.762 . . . . 0.0 108.957 179.622 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 37' ' ' SER . . . . . . . . . . . . . 9.9 t -77.77 -4.77 48.1 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 124.151 0.981 . . . . 0.0 110.128 178.553 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 63.53 25.9 69.17 Favored Glycine 0 CA--C 1.529 0.948 0 C-N-CA 124.662 1.125 . . . . 0.0 112.912 -179.842 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 39' ' ' LEU . . . . . . . . . . . . . 40.2 mt -119.19 120.94 38.56 Favored 'General case' 0 CA--C 1.507 -0.692 0 N-CA-C 105.439 -2.06 . . . . 0.0 105.439 179.729 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 40' ' ' THR . . . . . . . . . . . . . 12.8 t -53.54 148.87 8.71 Favored 'General case' 0 C--O 1.237 0.407 0 N-CA-C 108.43 -0.952 . . . . 0.0 108.43 178.44 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 41' ' ' VAL . . . . . . . . . . . . . 22.0 m -48.23 -34.3 4.8 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.721 0 CA-C-N 114.79 -1.096 . . . . 0.0 112.142 -179.149 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 42' ' ' SER . . . . . . . . . . . . . 22.9 t -61.27 -49.96 74.96 Favored 'General case' 0 CA--C 1.544 0.744 0 CA-C-N 119.611 1.096 . . . . 0.0 110.143 178.868 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -67.51 -43.42 80.92 Favored 'General case' 0 C--O 1.225 -0.212 0 C-N-CA 123.592 0.757 . . . . 0.0 109.078 178.722 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 44' ' ' TYR . . . . . . . . . . . . . 74.5 t80 -54.58 -50.47 67.92 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 123.163 0.585 . . . . 0.0 109.722 179.529 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 45' ' ' ILE . . . . . . . . . . . . . 12.4 mm -57.28 -64.23 0.55 Allowed 'Isoleucine or valine' 0 C--N 1.341 0.208 0 C-N-CA 125.762 1.625 . . . . 0.0 110.336 179.834 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 46' ' ' ARG . . . . . . . . . . . . . 21.9 ptt180 -53.12 -46.83 68.92 Favored 'General case' 0 C--O 1.222 -0.361 0 CA-C-O 119.148 -0.453 . . . . 0.0 111.06 -178.267 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 47' ' ' ASN . . . . . . . . . . . . . 34.5 t30 -57.76 -51.57 69.04 Favored 'General case' 0 N--CA 1.453 -0.279 0 CA-C-O 118.819 -0.61 . . . . 0.0 111.288 -179.527 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -61.2 -32.77 72.53 Favored 'General case' 0 CA--C 1.53 0.206 0 C-N-CA 123.326 0.651 . . . . 0.0 111.366 -179.899 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 49' ' ' ALA . . . . . . . . . . . . . . . -77.53 -17.72 57.66 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 124.416 1.086 . . . . 0.0 113.729 -179.438 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 22.0 mt -102.84 -37.24 7.94 Favored 'General case' 0 CA--C 1.517 -0.306 0 CA-C-N 118.857 0.753 . . . . 0.0 110.987 -179.546 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 51' ' ' ASN . . . . . . . . . . . . . 7.4 m-80 . . . . . 0 C--O 1.248 1.02 0 C-N-CA 125.302 1.441 . . . . 0.0 107.953 179.704 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 65.8 p . . . . . 0 N--CA 1.467 0.397 0 N-CA-C 109.315 -0.624 . . . . 0.0 109.315 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 5.7 p-10 -69.07 -15.47 63.45 Favored 'General case' 0 N--CA 1.468 0.465 0 C-N-CA 124.794 1.238 . . . . 0.0 111.288 178.657 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 32.4 t -127.44 139.91 52.51 Favored 'General case' 0 N--CA 1.445 -0.678 0 C-N-CA 125.087 1.355 . . . . 0.0 108.239 179.926 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -170.47 161.17 7.78 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 129.657 3.183 . . . . 0.0 106.92 179.069 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 14.5 m -151.48 173.19 0.95 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.335 0 C-N-CA 124.955 1.302 . . . . 0.0 110.131 179.294 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 20.5 mtp180 -71.39 127.61 33.15 Favored 'General case' 0 C--O 1.232 0.184 0 N-CA-C 105.397 -2.075 . . . . 0.0 105.397 177.934 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -145.1 174.63 10.89 Favored 'General case' 0 C--O 1.237 0.408 0 C-N-CA 123.756 0.822 . . . . 0.0 111.104 179.703 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 10.7 mptt -62.89 137.11 58.18 Favored 'General case' 0 C--O 1.232 0.147 0 C-N-CA 125.474 1.51 . . . . 0.0 109.668 -179.356 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 11.6 t -83.9 75.0 10.15 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-O 121.609 0.718 . . . . 0.0 109.76 179.836 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 71.8 mm-40 -80.84 18.4 1.0 Allowed 'General case' 0 CA--C 1.542 0.639 0 O-C-N 121.066 -1.021 . . . . 0.0 110.758 178.757 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 11.0 p -47.66 -38.7 6.54 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.345 0 C-N-CA 126.997 2.119 . . . . 0.0 112.159 -179.706 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 7.0 ptp180 -65.95 -29.51 69.93 Favored 'General case' 0 C--O 1.233 0.201 0 N-CA-C 114.145 1.165 . . . . 0.0 114.145 -179.552 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 10.5 tt0 -134.96 87.59 2.35 Favored 'General case' 0 C--O 1.227 -0.106 0 CA-C-N 120.433 1.47 . . . . 0.0 108.849 -179.75 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 21.6 pttm -70.0 -30.76 68.17 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.0 -0.546 . . . . 0.0 111.975 179.501 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 15' ' ' THR . . . . . 0.507 ' CG2' HH11 ' B' ' 21' ' ' ARG . 7.2 t -76.74 155.08 33.5 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-O 122.179 0.99 . . . . 0.0 108.861 178.952 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 18.0 t -91.85 149.15 4.22 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.724 0 N-CA-C 106.069 -1.826 . . . . 0.0 106.069 178.297 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 10.4 p -139.82 90.62 0.6 Allowed 'Isoleucine or valine' 0 N--CA 1.442 -0.863 0 N-CA-C 104.701 -2.333 . . . . 0.0 104.701 177.321 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 50.6 ttt180 -116.02 170.74 8.26 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 114.519 -1.219 . . . . 0.0 108.645 -179.288 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 10.8 m -117.09 128.34 55.05 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 106.846 -1.539 . . . . 0.0 106.846 179.779 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -125.9 150.47 47.91 Favored 'General case' 0 C--O 1.235 0.31 0 C-N-CA 124.949 1.3 . . . . 0.0 109.235 -179.362 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 68.5 mtt180 -137.8 158.7 43.82 Favored 'General case' 0 N--CA 1.447 -0.587 0 C-N-CA 125.411 1.485 . . . . 0.0 108.232 178.439 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 50.0 m-85 -145.12 156.57 43.96 Favored 'General case' 0 C--O 1.237 0.415 0 N-CA-C 107.84 -1.17 . . . . 0.0 107.84 179.687 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -68.91 168.9 12.92 Favored Pre-proline 0 CA--C 1.543 0.704 0 N-CA-C 107.421 -1.326 . . . . 0.0 107.421 178.7 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 25.3 Cg_endo -61.93 -45.06 17.69 Favored 'Trans proline' 0 N--CA 1.456 -0.702 0 CA-C-N 120.701 1.286 . . . . 0.0 111.264 -178.761 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 72.1 t -65.82 -42.6 92.57 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.29 0 C-N-CA 123.077 0.551 . . . . 0.0 109.908 179.536 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 7.2 mm-40 -60.35 -45.38 93.68 Favored 'General case' 0 CA--C 1.531 0.223 0 C-N-CA 123.307 0.643 . . . . 0.0 109.358 -179.893 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 26.9 t70 -66.59 -44.03 83.29 Favored 'General case' 0 C--O 1.221 -0.416 0 CA-C-O 118.984 -0.532 . . . . 0.0 110.223 179.562 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 31.7 tt0 -58.08 -43.55 87.07 Favored 'General case' 0 CA--C 1.531 0.213 0 C-N-CA 124.758 1.223 . . . . 0.0 109.055 178.976 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 37.4 m -61.22 -50.63 72.31 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 124.283 1.033 . . . . 0.0 108.634 179.273 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 64.7 mt -61.49 -41.34 89.68 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.327 0 N-CA-C 109.262 -0.644 . . . . 0.0 109.262 179.677 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 23.3 ttp85 -60.39 -46.39 90.14 Favored 'General case' 0 N--CA 1.461 0.099 0 C-N-CA 124.003 0.921 . . . . 0.0 109.575 -179.627 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 1.9 mptm? -59.98 -59.04 6.05 Favored 'General case' 0 N--CA 1.45 -0.453 0 C-N-CA 124.993 1.317 . . . . 0.0 110.956 179.537 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 17.5 tptt -60.84 -40.86 94.43 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-O 118.576 -0.726 . . . . 0.0 111.588 -177.479 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -58.45 -51.65 68.94 Favored 'General case' 0 N--CA 1.452 -0.348 0 N-CA-C 108.596 -0.89 . . . . 0.0 108.596 178.813 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 21.8 tt0 -62.17 -41.99 98.84 Favored 'General case' 0 CA--C 1.529 0.157 0 C-N-CA 123.238 0.615 . . . . 0.0 112.093 -179.565 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 38.7 t70 -66.56 -22.88 66.15 Favored 'General case' 0 C--O 1.232 0.167 0 C-N-CA 126.562 1.945 . . . . 0.0 111.281 -179.856 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 10.4 t -97.15 -8.28 30.47 Favored 'General case' 0 N--CA 1.449 -0.523 0 C-N-CA 127.076 2.151 . . . . 0.0 110.994 179.688 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 64.11 31.66 81.59 Favored Glycine 0 CA--C 1.532 1.134 0 O-C-N 120.723 -1.236 . . . . 0.0 111.418 -179.327 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 55.7 mt -127.8 132.54 49.47 Favored 'General case' 0 N--CA 1.448 -0.536 0 N-CA-C 105.2 -2.148 . . . . 0.0 105.2 -179.981 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 8.4 t -61.75 152.76 30.35 Favored 'General case' 0 CA--C 1.538 0.5 0 N-CA-C 107.692 -1.225 . . . . 0.0 107.692 178.679 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 24.1 t -48.33 -41.32 10.8 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.289 0 C-N-CA 124.549 1.14 . . . . 0.0 111.755 -179.974 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 42' ' ' SER . . . . . 0.432 ' HA ' HD21 ' B' ' 20' ' ' LEU . 13.5 p -63.65 -38.25 90.39 Favored 'General case' 0 CA--C 1.532 0.255 0 O-C-N 121.024 -1.048 . . . . 0.0 112.08 179.841 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -69.66 -46.86 65.17 Favored 'General case' 0 C--O 1.222 -0.354 0 N-CA-C 107.607 -1.257 . . . . 0.0 107.607 178.334 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 69.6 t80 -52.87 -46.31 67.85 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 123.973 0.909 . . . . 0.0 110.112 179.152 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 14.8 mm -56.98 -63.57 0.63 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.315 0 C-N-CA 124.044 0.938 . . . . 0.0 110.526 179.429 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 12.4 ptt180 -55.47 -45.16 76.94 Favored 'General case' 0 C--O 1.222 -0.365 0 C-N-CA 123.497 0.719 . . . . 0.0 110.989 -178.55 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 32.2 t30 -58.69 -55.79 30.6 Favored 'General case' 0 N--CA 1.449 -0.521 0 C-N-CA 124.601 1.16 . . . . 0.0 109.065 -179.189 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -61.77 -25.9 67.75 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 123.065 0.546 . . . . 0.0 112.442 179.637 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -79.07 -19.38 51.44 Favored 'General case' 0 CA--C 1.536 0.44 0 N-CA-C 113.341 0.867 . . . . 0.0 113.341 179.523 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 7.9 mt -115.3 -29.03 6.7 Favored 'General case' 0 N--CA 1.466 0.328 0 N-CA-C 114.133 1.16 . . . . 0.0 114.133 -177.966 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 2.0 m-80 . . . . . 0 C--O 1.249 1.048 0 C-N-CA 125.512 1.525 . . . . 0.0 110.3 -178.183 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B ' 1' ' ' SER . . . . . . . . . . . . . 77.3 p . . . . . 0 N--CA 1.466 0.331 0 CA-C-O 118.802 -0.618 . . . . 0.0 110.671 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B ' 2' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -55.14 -64.23 0.9 Allowed 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 126.667 1.987 . . . . 0.0 109.764 178.328 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 3' ' ' SER . . . . . . . . . . . . . 29.6 t -69.85 103.7 2.27 Favored 'General case' 0 N--CA 1.443 -0.784 0 C-N-CA 127.235 2.214 . . . . 0.0 106.783 179.186 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 4' ' ' ALA . . . . . . . . . . . . . . . -130.25 82.42 2.06 Favored 'General case' 0 CA--C 1.531 0.221 0 C-N-CA 125.243 1.417 . . . . 0.0 111.275 -179.311 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 34.8 m -89.72 173.76 0.85 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.414 0 N-CA-C 108.839 -0.8 . . . . 0.0 108.839 178.53 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 6' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -72.95 141.04 47.8 Favored 'General case' 0 C--O 1.234 0.275 0 O-C-N 121.57 -0.706 . . . . 0.0 109.434 179.033 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -124.79 153.3 42.69 Favored 'General case' 0 C--O 1.237 0.426 0 N-CA-C 106.13 -1.804 . . . . 0.0 106.13 177.403 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 12.1 mptt -72.6 177.12 4.91 Favored 'General case' 0 CA--C 1.538 0.506 0 N-CA-C 107.846 -1.168 . . . . 0.0 107.846 -179.494 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 20.5 t -93.45 97.49 10.58 Favored 'General case' 0 C--N 1.331 -0.229 0 O-C-N 120.409 -1.432 . . . . 0.0 108.513 -179.947 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 10' ' ' GLU . . . . . . . . . . . . . 3.0 pm0 -123.56 7.06 8.89 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 125.069 1.348 . . . . 0.0 111.841 179.366 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 11' ' ' VAL . . . . . . . . . . . . . 13.8 p -53.15 -30.76 17.05 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.379 0 C-N-CA 124.782 1.233 . . . . 0.0 111.631 179.627 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 12' ' ' ARG . . . . . . . . . . . . . 9.5 ptm180 -56.8 -20.26 21.56 Favored 'General case' 0 C--O 1.233 0.21 0 C-N-CA 124.065 0.946 . . . . 0.0 112.637 179.299 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 13' ' ' GLN . . . . . . . . . . . . . 36.9 tt0 -151.36 80.01 1.29 Allowed 'General case' 0 N--CA 1.447 -0.581 0 N-CA-C 106.69 -1.596 . . . . 0.0 106.69 179.89 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 24.3 pttm -64.64 -30.99 72.02 Favored 'General case' 0 N--CA 1.462 0.174 0 C-N-CA 123.946 0.898 . . . . 0.0 112.58 179.538 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 7.9 t -65.09 170.47 4.45 Favored 'General case' 0 N--CA 1.449 -0.483 0 N-CA-C 106.201 -1.777 . . . . 0.0 106.201 178.184 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 9.3 p -109.98 155.99 11.03 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.813 0 N-CA-C 104.619 -2.363 . . . . 0.0 104.619 177.391 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 14.2 p -138.79 122.18 19.3 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.734 0 N-CA-C 106.305 -1.739 . . . . 0.0 106.305 177.964 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 23.8 ttt180 -140.65 159.09 42.97 Favored 'General case' 0 CA--C 1.516 -0.334 0 CA-C-O 122.826 1.298 . . . . 0.0 111.44 179.565 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 1.3 m -108.06 102.47 11.63 Favored 'General case' 0 N--CA 1.445 -0.71 0 N-CA-C 101.294 -3.595 . . . . 0.0 101.294 179.693 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 20' ' ' LEU . . . . . 0.432 HD21 ' HA ' ' A' ' 42' ' ' SER . 0.2 OUTLIER -108.52 120.28 41.98 Favored 'General case' 0 CA--C 1.515 -0.372 0 C-N-CA 124.437 1.095 . . . . 0.0 108.375 -178.504 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 21' ' ' ARG . . . . . 0.507 HH11 ' CG2' ' A' ' 15' ' ' THR . 24.2 mtt180 -95.71 153.65 17.62 Favored 'General case' 0 N--CA 1.449 -0.493 0 N-CA-C 109.109 -0.7 . . . . 0.0 109.109 179.188 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 22' ' ' PHE . . . . . . . . . . . . . 92.9 m-85 -134.88 144.27 47.44 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 106.728 -1.582 . . . . 0.0 106.728 -179.814 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -74.78 171.16 12.28 Favored Pre-proline 0 CA--C 1.544 0.741 0 N-CA-C 108.075 -1.083 . . . . 0.0 108.075 179.948 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 24' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -66.94 -31.32 38.12 Favored 'Trans proline' 0 N--CA 1.459 -0.547 0 C-N-CA 121.472 1.448 . . . . 0.0 113.562 -178.332 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 25' ' ' VAL . . . . . . . . . . . . . 89.8 t -75.37 -40.8 42.81 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.307 0 N-CA-C 109.031 -0.729 . . . . 0.0 109.031 -179.832 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -62.86 -48.18 80.13 Favored 'General case' 0 C--O 1.217 -0.631 0 N-CA-C 108.164 -1.051 . . . . 0.0 108.164 179.889 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 27' ' ' ASP . . . . . . . . . . . . . 20.9 t0 -56.03 -48.51 75.84 Favored 'General case' 0 CA--C 1.515 -0.385 0 C-N-CA 124.899 1.28 . . . . 0.0 111.169 -179.514 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 28' ' ' GLU . . . . . . . . . . . . . 36.1 tt0 -60.51 -47.15 87.42 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 124.58 1.152 . . . . 0.0 108.833 179.097 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 31.7 m -60.89 -55.15 36.37 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 124.167 0.987 . . . . 0.0 110.428 179.484 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 96.7 mt -62.21 -30.83 49.73 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.48 0 C-N-CA 126.132 1.773 . . . . 0.0 110.641 -178.654 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 9.6 ttt85 -67.58 -43.82 79.64 Favored 'General case' 0 C--N 1.327 -0.395 0 O-C-N 120.515 -1.366 . . . . 0.0 110.104 179.437 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 1.2 mptm? -78.47 -44.46 24.53 Favored 'General case' 0 C--O 1.225 -0.214 0 CA-C-O 117.552 -1.213 . . . . 0.0 113.918 -178.07 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 34.9 tptt -62.64 -39.68 94.61 Favored 'General case' 0 N--CA 1.462 0.166 0 CA-C-N 119.966 1.257 . . . . 0.0 110.615 -178.109 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 34' ' ' ALA . . . . . . . . . . . . . . . -58.73 -55.74 31.17 Favored 'General case' 0 N--CA 1.448 -0.539 0 C-N-CA 124.839 1.256 . . . . 0.0 109.019 179.072 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 16.8 tt0 -65.46 -34.89 79.35 Favored 'General case' 0 N--CA 1.453 -0.316 0 CA-C-N 115.37 -0.832 . . . . 0.0 113.027 -178.321 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 36' ' ' ASP . . . . . . . . . . . . . 18.3 t70 -64.86 -40.85 95.79 Favored 'General case' 0 C--O 1.235 0.334 0 N-CA-C 107.929 -1.137 . . . . 0.0 107.929 178.361 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 37' ' ' SER . . . . . . . . . . . . . 6.9 t -77.75 -7.17 56.17 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 124.887 1.275 . . . . 0.0 110.671 178.821 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 72.7 2.54 56.7 Favored Glycine 0 CA--C 1.534 1.265 0 C-N-CA 125.032 1.301 . . . . 0.0 112.257 -179.068 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 39' ' ' LEU . . . . . . . . . . . . . 11.2 mt -99.6 106.31 18.27 Favored 'General case' 0 N--CA 1.447 -0.6 0 C-N-CA 125.952 1.701 . . . . 0.0 107.294 -179.52 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 40' ' ' THR . . . . . . . . . . . . . 8.8 t -45.27 150.83 0.4 Allowed 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 124.947 1.299 . . . . 0.0 109.67 179.016 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 41' ' ' VAL . . . . . . . . . . . . . 65.4 t -43.46 -44.64 1.61 Allowed 'Isoleucine or valine' 0 N--CA 1.461 0.096 0 C-N-CA 125.85 1.66 . . . . 0.0 112.473 -177.705 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 42' ' ' SER . . . . . . . . . . . . . 1.4 p -61.41 -46.75 88.84 Favored 'General case' 0 CA--C 1.538 0.489 0 CA-C-N 119.518 1.053 . . . . 0.0 111.615 179.896 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -66.52 -39.03 88.41 Favored 'General case' 0 C--O 1.225 -0.2 0 C-N-CA 123.251 0.621 . . . . 0.0 109.566 178.557 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 44' ' ' TYR . . . . . . . . . . . . . 61.7 t80 -58.82 -52.85 63.96 Favored 'General case' 0 C--O 1.221 -0.413 0 N-CA-C 108.495 -0.928 . . . . 0.0 108.495 179.134 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 45' ' ' ILE . . . . . . . . . . . . . 21.2 mm -53.45 -61.63 0.84 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.196 0 C-N-CA 124.173 0.989 . . . . 0.0 109.577 179.819 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 46' ' ' ARG . . . . . . . . . . . . . 18.4 ptt180 -52.0 -47.51 64.88 Favored 'General case' 0 CA--C 1.53 0.194 0 N-CA-C 112.704 0.631 . . . . 0.0 112.704 -179.012 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 47' ' ' ASN . . . . . . . . . . . . . 32.6 t30 -66.05 -52.44 48.96 Favored 'General case' 0 C--N 1.329 -0.322 0 C-N-CA 125.37 1.468 . . . . 0.0 112.987 -179.352 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -61.84 -33.26 73.84 Favored 'General case' 0 C--O 1.223 -0.333 0 C-N-CA 125.293 1.437 . . . . 0.0 110.976 -179.594 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 49' ' ' ALA . . . . . . . . . . . . . . . -66.71 -55.57 14.51 Favored 'General case' 0 N--CA 1.444 -0.762 0 C-N-CA 122.41 0.284 . . . . 0.0 111.02 -179.77 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 14.8 mt -69.62 -40.19 76.74 Favored 'General case' 0 CA--C 1.516 -0.341 0 N-CA-C 115.562 1.69 . . . . 0.0 115.562 -177.327 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 51' ' ' ASN . . . . . . . . . . . . . 57.0 m-80 . . . . . 0 C--O 1.251 1.153 0 CA-C-O 118.321 -0.847 . . . . 0.0 111.165 -176.774 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 44.5 m . . . . . 0 N--CA 1.47 0.533 0 N-CA-C 107.496 -1.298 . . . . 0.0 107.496 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 44.6 m-20 -71.76 174.49 6.77 Favored 'General case' 0 C--O 1.237 0.433 0 C-N-CA 123.393 0.677 . . . . 0.0 111.803 -178.092 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 19.3 p -136.02 171.49 14.4 Favored 'General case' 0 C--O 1.234 0.265 0 C-N-CA 125.18 1.392 . . . . 0.0 110.462 -179.831 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -71.56 102.43 2.72 Favored 'General case' 0 N--CA 1.453 -0.311 0 N-CA-C 105.521 -2.029 . . . . 0.0 105.521 178.358 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 12.5 p -123.16 -36.61 1.2 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 C-N-CA 124.78 1.232 . . . . 0.0 110.047 -178.822 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 29.5 mtp-105 -86.4 160.86 18.93 Favored 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 125.598 1.559 . . . . 0.0 106.817 178.838 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 28.7 mtpt -129.52 -92.84 0.44 Allowed 'General case' 0 N--CA 1.465 0.279 0 O-C-N 121.144 -0.973 . . . . 0.0 108.987 -179.866 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 18.9 pttp -135.69 105.95 6.37 Favored 'General case' 0 C--O 1.235 0.293 0 C-N-CA 124.676 1.19 . . . . 0.0 110.426 -179.456 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 65.8 m -144.75 131.39 19.97 Favored 'General case' 0 C--N 1.332 -0.163 0 C-N-CA 124.209 1.003 . . . . 0.0 108.328 178.847 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 -94.34 81.47 4.0 Favored 'General case' 0 C--N 1.331 -0.221 0 N-CA-C 108.8 -0.815 . . . . 0.0 108.8 -179.274 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 94.7 t -138.11 129.75 38.43 Favored 'Isoleucine or valine' 0 C--O 1.235 0.316 0 N-CA-C 106.261 -1.755 . . . . 0.0 106.261 179.379 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 24.9 ptt180 -130.76 86.37 2.37 Favored 'General case' 0 C--N 1.333 -0.15 0 C-N-CA 124.679 1.192 . . . . 0.0 108.514 -179.866 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 13.8 pt20 -127.05 104.33 7.93 Favored 'General case' 0 CA--C 1.519 -0.226 0 C-N-CA 125.065 1.346 . . . . 0.0 109.941 -179.517 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 15.0 ptmt -98.25 27.41 4.67 Favored 'General case' 0 C--N 1.327 -0.386 0 O-C-N 121.65 -0.656 . . . . 0.0 109.955 178.45 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 11.8 t -160.89 159.46 29.74 Favored 'General case' 0 N--CA 1.437 -1.1 0 N-CA-C 107.844 -1.169 . . . . 0.0 107.844 179.398 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 95.9 t -97.28 154.64 3.69 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.879 0 N-CA-C 104.457 -2.423 . . . . 0.0 104.457 177.835 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 8.3 p -144.09 101.85 0.7 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.532 0 N-CA-C 105.598 -2.001 . . . . 0.0 105.598 178.68 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 10.6 ttm180 -144.09 172.7 12.53 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 107.843 -1.169 . . . . 0.0 107.843 179.392 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -121.59 136.87 54.93 Favored 'General case' 0 C--N 1.321 -0.637 0 C-N-CA 127.217 2.207 . . . . 0.0 107.597 -179.567 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 74.0 mt -120.84 170.8 9.13 Favored 'General case' 0 C--O 1.236 0.39 0 N-CA-C 107.464 -1.309 . . . . 0.0 107.464 178.547 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 23.4 mmt-85 -128.77 151.16 49.88 Favored 'General case' 0 C--N 1.327 -0.412 0 C-N-CA 124.978 1.311 . . . . 0.0 107.967 179.639 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 98.5 m-85 -147.87 140.91 24.95 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 106.429 -1.693 . . . . 0.0 106.429 179.588 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 1.5 m -68.96 172.14 5.37 Favored Pre-proline 0 CA--C 1.545 0.755 0 C-N-CA 124.26 1.024 . . . . 0.0 108.664 179.381 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 59.4 Cg_endo -67.72 -38.28 14.21 Favored 'Trans proline' 0 N--CA 1.458 -0.609 0 CA-C-N 121.271 1.49 . . . . 0.0 111.351 -179.067 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 21.3 t -72.46 -36.38 54.34 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.488 0 C-N-CA 123.105 0.562 . . . . 0.0 109.796 179.632 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -67.85 -42.66 81.03 Favored 'General case' 0 C--O 1.225 -0.224 0 N-CA-C 108.724 -0.843 . . . . 0.0 108.724 179.377 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 26.5 t70 -65.4 -46.02 81.68 Favored 'General case' 0 C--O 1.224 -0.286 0 N-CA-C 108.915 -0.772 . . . . 0.0 108.915 178.763 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 63.9 tt0 -54.74 -48.57 72.4 Favored 'General case' 0 N--CA 1.452 -0.367 0 C-N-CA 125.112 1.365 . . . . 0.0 108.052 178.23 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 46.1 m -67.51 -51.31 52.6 Favored 'General case' 0 C--O 1.222 -0.388 0 C-N-CA 124.149 0.98 . . . . 0.0 111.3 -179.441 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 59.6 mt -60.25 -31.96 49.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 O-C-N 120.52 -1.363 . . . . 0.0 110.109 -179.436 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 31.9 ttt180 -76.24 -45.14 34.31 Favored 'General case' 0 CA--C 1.511 -0.545 0 N-CA-C 109.318 -0.623 . . . . 0.0 109.318 -179.151 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . 0.391 0.0 OUTLIER -66.04 -30.64 71.21 Favored 'General case' 0 N--CA 1.45 -0.447 0 O-C-N 123.277 0.361 . . . . 0.0 110.259 -179.856 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 7.4 mmmm -77.48 -48.91 15.92 Favored 'General case' 0 C--O 1.222 -0.362 0 N-CA-C 107.346 -1.353 . . . . 0.0 107.346 178.178 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -54.4 -57.14 12.45 Favored 'General case' 0 C--N 1.339 0.112 0 C-N-CA 124.083 0.953 . . . . 0.0 110.278 -179.803 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 7.5 tp10 -62.96 -41.26 99.47 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-O 118.881 -0.581 . . . . 0.0 111.845 -179.059 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 37.0 t70 -66.36 -26.84 67.46 Favored 'General case' 0 N--CA 1.47 0.571 0 CA-C-N 119.435 1.016 . . . . 0.0 110.724 179.771 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 1.7 t -89.81 -2.28 58.18 Favored 'General case' 0 N--CA 1.447 -0.625 0 C-N-CA 124.533 1.133 . . . . 0.0 110.119 178.861 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 65.23 33.97 88.29 Favored Glycine 0 CA--C 1.526 0.77 0 CA-C-O 118.835 -0.98 . . . . 0.0 112.569 179.627 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 81.0 mt -128.29 152.58 47.96 Favored 'General case' 0 C--O 1.233 0.23 0 C-N-CA 125.502 1.521 . . . . 0.0 108.589 179.924 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -76.71 148.48 36.75 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 104.24 -2.504 . . . . 0.0 104.24 177.183 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 20.1 t -50.35 -39.78 17.35 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.539 0 C-N-CA 124.683 1.193 . . . . 0.0 109.477 177.844 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 66.2 p -58.75 -48.14 82.24 Favored 'General case' 0 CA--C 1.539 0.555 0 O-C-N 121.105 -0.997 . . . . 0.0 111.777 179.47 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -67.6 -46.44 72.58 Favored 'General case' 0 C--O 1.221 -0.403 0 C-N-CA 125.09 1.356 . . . . 0.0 108.581 179.053 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 55.0 t80 -52.66 -53.66 44.09 Favored 'General case' 0 N--CA 1.451 -0.379 0 C-N-CA 124.703 1.201 . . . . 0.0 109.487 179.959 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 18.4 mm -51.94 -62.11 0.63 Allowed 'Isoleucine or valine' 0 C--N 1.341 0.218 0 C-N-CA 124.575 1.15 . . . . 0.0 111.258 -179.784 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 12.7 ptm180 -60.92 -46.28 91.31 Favored 'General case' 0 C--O 1.222 -0.374 0 CA-C-O 118.687 -0.673 . . . . 0.0 111.687 -178.682 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 10.7 t30 -51.96 -55.22 21.7 Favored 'General case' 0 C--N 1.332 -0.184 0 C-N-CA 124.405 1.082 . . . . 0.0 110.089 -179.443 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -66.18 -29.83 70.18 Favored 'General case' 0 N--CA 1.453 -0.298 0 C-N-CA 124.99 1.316 . . . . 0.0 113.149 179.924 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -81.38 -19.8 41.9 Favored 'General case' 0 N--CA 1.462 0.151 0 N-CA-C 113.362 0.875 . . . . 0.0 113.362 -179.303 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 23.4 mt -106.19 -36.98 6.73 Favored 'General case' 0 CA--C 1.516 -0.332 0 N-CA-C 114.015 1.117 . . . . 0.0 114.015 -178.533 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 12.7 m-80 . . . . . 0 C--O 1.248 1.015 0 CA-C-O 117.805 -1.093 . . . . 0.0 110.972 -176.975 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' B' B ' 1' ' ' SER . . . . . . . . . . . . . 38.2 m . . . . . 0 C--O 1.237 0.418 0 CA-C-O 120.409 0.147 . . . . 0.0 110.819 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' B' B ' 2' ' ' ASP . . . . . . . . . . . . . 3.5 p-10 -92.96 166.03 12.58 Favored 'General case' 0 N--CA 1.464 0.261 0 C-N-CA 124.259 1.024 . . . . 0.0 108.867 178.791 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 3' ' ' SER . . . . . . . . . . . . . 51.5 p -135.34 163.82 29.14 Favored 'General case' 0 C--O 1.241 0.609 0 C-N-CA 124.683 1.193 . . . . 0.0 111.394 -178.909 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 4' ' ' ALA . . . . . . . . . . . . . . . -78.54 75.96 5.05 Favored 'General case' 0 N--CA 1.451 -0.389 0 C-N-CA 124.907 1.283 . . . . 0.0 108.58 178.995 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 10.4 p -79.63 -27.19 12.62 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.543 0 C-N-CA 123.909 0.884 . . . . 0.0 108.931 178.952 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 6' ' ' ARG . . . . . . . . . . . . . 87.0 mtt180 -70.64 163.39 27.15 Favored 'General case' 0 CA--C 1.534 0.338 0 N-CA-C 108.528 -0.915 . . . . 0.0 108.528 178.274 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 54.0 mtpt -133.4 -77.37 0.48 Allowed 'General case' 0 N--CA 1.467 0.384 0 O-C-N 121.263 -0.898 . . . . 0.0 109.955 -179.824 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 13.0 pttp -154.51 88.07 1.2 Allowed 'General case' 0 N--CA 1.456 -0.161 0 C-N-CA 123.806 0.842 . . . . 0.0 109.128 -179.486 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 33.3 m -136.08 136.49 40.21 Favored 'General case' 0 C--O 1.235 0.327 0 N-CA-C 107.773 -1.195 . . . . 0.0 107.773 179.517 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 10' ' ' GLU . . . . . . . . . . . . . 3.6 tt0 -99.62 0.73 42.68 Favored 'General case' 0 CA--C 1.532 0.287 0 N-CA-C 115.543 1.683 . . . . 0.0 115.543 -177.819 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 11' ' ' VAL . . . . . . . . . . . . . 89.4 t -74.34 138.72 20.55 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 N-CA-C 107.725 -1.213 . . . . 0.0 107.725 179.631 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 12' ' ' ARG . . . . . . . . . . . . . 80.5 mtt180 -140.0 130.68 25.78 Favored 'General case' 0 C--O 1.236 0.389 0 CA-C-N 119.29 0.95 . . . . 0.0 110.823 -179.536 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 13' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -148.21 96.39 2.62 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 124.171 0.988 . . . . 0.0 109.878 178.623 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 12.7 ptmt -80.25 23.96 0.46 Allowed 'General case' 0 N--CA 1.466 0.363 0 O-C-N 120.974 -1.079 . . . . 0.0 110.713 179.158 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 14.3 t -167.37 164.13 15.16 Favored 'General case' 0 N--CA 1.44 -0.955 0 C-N-CA 126.213 1.805 . . . . 0.0 106.634 -179.637 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 5.4 t -109.8 156.97 10.47 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.574 0 N-CA-C 106.515 -1.661 . . . . 0.0 106.515 177.909 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 11.5 p -137.69 113.67 11.06 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.681 0 N-CA-C 105.182 -2.155 . . . . 0.0 105.182 176.939 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 34.5 ttm-85 -145.19 149.11 34.37 Favored 'General case' 0 CA--C 1.514 -0.422 0 CA-C-O 121.059 0.457 . . . . 0.0 109.8 178.936 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -93.85 132.77 37.93 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 107.402 -1.333 . . . . 0.0 107.402 -179.482 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 69.9 mt -129.49 151.96 49.54 Favored 'General case' 0 C--O 1.239 0.542 0 N-CA-C 107.532 -1.284 . . . . 0.0 107.532 178.747 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 22.0 mmt85 -112.6 151.19 30.37 Favored 'General case' 0 C--N 1.323 -0.571 0 C-N-CA 127.977 2.511 . . . . 0.0 108.234 -179.798 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 22' ' ' PHE . . . . . . . . . . . . . 89.7 m-85 -148.73 139.43 22.78 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 104.829 -2.285 . . . . 0.0 104.829 178.769 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 4.7 m -70.57 168.54 18.97 Favored Pre-proline 0 CA--C 1.551 1.012 0 N-CA-C 108.279 -1.008 . . . . 0.0 108.279 179.408 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 24' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -66.14 -40.88 14.33 Favored 'Trans proline' 0 N--CA 1.46 -0.456 0 C-N-CA 122.475 2.117 . . . . 0.0 114.178 -177.363 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 25' ' ' VAL . . . . . . . . . . . . . 77.1 t -66.81 -45.62 87.31 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.305 0 C-N-CA 123.94 0.896 . . . . 0.0 109.51 -179.709 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -68.08 -38.85 82.84 Favored 'General case' 0 N--CA 1.453 -0.297 0 C-N-CA 124.68 1.192 . . . . 0.0 110.983 -178.495 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 27' ' ' ASP . . . . . . . . . . . . . 10.1 t70 -64.59 -44.1 91.7 Favored 'General case' 0 N--CA 1.454 -0.264 0 C-N-CA 123.102 0.561 . . . . 0.0 109.998 178.473 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 28' ' ' GLU . . . . . . . . . . . . . 26.5 tt0 -62.16 -45.75 92.02 Favored 'General case' 0 N--CA 1.449 -0.514 0 N-CA-C 108.105 -1.072 . . . . 0.0 108.105 179.556 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 31.0 m -56.06 -52.91 62.56 Favored 'General case' 0 C--N 1.341 0.199 0 N-CA-C 108.512 -0.921 . . . . 0.0 108.512 178.699 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 84.4 mt -58.0 -41.17 79.66 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.3 0 C-N-CA 122.66 0.384 . . . . 0.0 110.099 -179.717 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 37.4 ttt-85 -61.42 -47.43 85.81 Favored 'General case' 0 C--O 1.23 0.067 0 O-C-N 121.45 -0.781 . . . . 0.0 110.62 -179.647 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 2.6 mptm? -65.48 -46.83 78.2 Favored 'General case' 0 CA--C 1.523 -0.083 0 C-N-CA 123.008 0.523 . . . . 0.0 110.473 -179.593 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 9.1 mmmm -59.46 -48.31 82.13 Favored 'General case' 0 CA--C 1.527 0.065 0 N-CA-C 109.272 -0.64 . . . . 0.0 109.272 -179.655 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 34' ' ' ALA . . . . . . . . . . . . . . . -59.43 -49.77 76.52 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 124.768 1.227 . . . . 0.0 112.156 -179.821 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 5.4 tp10 -56.0 -49.69 72.94 Favored 'General case' 0 C--O 1.233 0.186 0 C-N-CA 124.414 1.086 . . . . 0.0 110.696 -179.495 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 36' ' ' ASP . . . . . . . . . . . . . 6.8 t70 -67.89 -44.05 77.88 Favored 'General case' 0 N--CA 1.454 -0.262 0 C-N-CA 124.107 0.963 . . . . 0.0 111.875 -178.927 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 37' ' ' SER . . . . . . . . . . . . . 30.4 t -66.24 -18.77 65.56 Favored 'General case' 0 N--CA 1.448 -0.556 0 C-N-CA 124.403 1.081 . . . . 0.0 110.943 -179.453 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 73.47 20.35 79.84 Favored Glycine 0 CA--C 1.528 0.893 0 N-CA-C 110.632 -0.987 . . . . 0.0 110.632 -179.189 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 39' ' ' LEU . . . . . . . . . . . . . 81.4 mt -120.45 107.81 13.34 Favored 'General case' 0 N--CA 1.447 -0.576 0 N-CA-C 103.121 -2.918 . . . . 0.0 103.121 179.56 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 40' ' ' THR . . . . . . . . . . . . . 13.8 t -50.76 156.3 0.98 Allowed 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 123.342 0.657 . . . . 0.0 109.502 -179.776 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 41' ' ' VAL . . . . . . . . . . . . . 80.8 t -44.99 -43.97 2.72 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.418 0 C-N-CA 125.019 1.328 . . . . 0.0 112.804 -177.74 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 42' ' ' SER . . . . . . . . . . . . . 9.8 p -65.48 -42.77 91.85 Favored 'General case' 0 CA--C 1.542 0.642 0 CA-C-N 119.256 0.935 . . . . 0.0 112.276 179.474 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -66.31 -45.39 80.53 Favored 'General case' 0 C--O 1.226 -0.183 0 C-N-CA 125.545 1.538 . . . . 0.0 108.921 178.941 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 44' ' ' TYR . . . . . . . . . . . . . 72.3 t80 -56.25 -51.31 68.6 Favored 'General case' 0 N--CA 1.443 -0.781 0 C-N-CA 125.685 1.594 . . . . 0.0 109.256 179.627 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 45' ' ' ILE . . . . . . . . . . . . . 9.0 mm -56.12 -58.94 3.41 Favored 'Isoleucine or valine' 0 C--N 1.34 0.162 0 C-N-CA 123.427 0.691 . . . . 0.0 110.952 179.561 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 46' ' ' ARG . . . . . . . . . . . . . 13.3 ptm180 -57.52 -48.97 77.84 Favored 'General case' 0 C--O 1.221 -0.426 0 CA-C-O 118.213 -0.898 . . . . 0.0 111.113 -178.832 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 47' ' ' ASN . . . . . . . . . . . . . 20.1 t30 -55.4 -55.94 25.89 Favored 'General case' 0 N--CA 1.452 -0.349 0 CA-C-N 118.935 0.789 . . . . 0.0 110.837 -179.493 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -59.9 -26.8 66.2 Favored 'General case' 0 CA--C 1.531 0.245 0 C-N-CA 123.529 0.732 . . . . 0.0 112.816 -179.486 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 49' ' ' ALA . . . . . . . . . . . . . . . -84.29 -12.48 54.59 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 124.176 0.991 . . . . 0.0 113.073 179.746 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 14.2 mt -109.99 -30.06 7.96 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 118.856 0.753 . . . . 0.0 111.481 179.749 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 51' ' ' ASN . . . . . . . . . . . . . 11.8 m-80 . . . . . 0 C--O 1.249 1.048 0 C-N-CA 126.057 1.743 . . . . 0.0 109.805 -178.815 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 8.4 t . . . . . 0 N--CA 1.434 -1.254 0 N-CA-C 108.59 -0.893 . . . . 0.0 108.59 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 2.5 t -103.92 134.34 45.44 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.801 0 N-CA-C 104.763 -2.31 . . . . 0.0 104.763 178.344 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 8.8 p -127.32 111.63 25.87 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 N-CA-C 106.295 -1.743 . . . . 0.0 106.295 179.102 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 61.6 ttm-85 -141.68 157.7 44.74 Favored 'General case' 0 CA--C 1.52 -0.206 0 CA-C-N 115.447 -0.797 . . . . 0.0 108.972 -179.807 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 45.0 m -95.7 110.03 22.23 Favored 'General case' 0 N--CA 1.448 -0.544 0 N-CA-C 104.62 -2.363 . . . . 0.0 104.62 178.674 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 12.6 tp -104.24 145.9 29.56 Favored 'General case' 0 C--O 1.237 0.428 0 N-CA-C 106.839 -1.541 . . . . 0.0 106.839 179.841 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 33.1 mtt180 -127.74 161.3 29.28 Favored 'General case' 0 N--CA 1.453 -0.298 0 C-N-CA 123.529 0.732 . . . . 0.0 110.306 -179.538 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 95.1 m-85 -149.49 159.03 44.65 Favored 'General case' 0 N--CA 1.465 0.298 0 C-N-CA 124.311 1.045 . . . . 0.0 108.818 -179.117 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -84.91 169.87 15.15 Favored Pre-proline 0 CA--C 1.542 0.658 0 N-CA-C 108.477 -0.935 . . . . 0.0 108.477 178.578 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -61.49 -32.64 88.5 Favored 'Trans proline' 0 C--N 1.349 0.602 0 C-N-CA 122.04 1.827 . . . . 0.0 111.811 -178.834 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 93.4 t -66.23 -58.38 6.86 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.419 0 C-N-CA 125.885 1.674 . . . . 0.0 108.511 179.526 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -56.66 -40.15 74.99 Favored 'General case' 0 CA--C 1.521 -0.148 0 CA-C-N 118.146 0.43 . . . . 0.0 111.389 -179.722 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 32.8 t70 -65.49 -42.68 91.89 Favored 'General case' 0 CA--C 1.512 -0.483 0 C-N-CA 123.989 0.916 . . . . 0.0 110.994 179.647 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 34.9 tt0 -60.28 -52.64 64.43 Favored 'General case' 0 N--CA 1.448 -0.56 0 N-CA-C 107.738 -1.208 . . . . 0.0 107.738 179.328 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 57.0 m -56.41 -56.46 20.92 Favored 'General case' 0 N--CA 1.451 -0.385 0 C-N-CA 123.046 0.538 . . . . 0.0 110.161 -179.194 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 27.8 mt -58.82 -43.38 88.02 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.536 0 N-CA-C 112.412 0.523 . . . . 0.0 112.412 -178.576 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 31.6 ttt180 -59.14 -47.0 86.9 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 118.616 0.644 . . . . 0.0 109.814 179.63 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 2.3 mptm? -66.72 -40.89 88.57 Favored 'General case' 0 CA--C 1.529 0.153 0 CA-C-O 119.456 -0.307 . . . . 0.0 110.248 -179.726 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 8.4 tptt -64.73 -44.41 90.26 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-N 118.994 0.815 . . . . 0.0 111.118 -179.361 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -61.55 -53.16 59.96 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 124.377 1.071 . . . . 0.0 111.12 -179.856 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 3.7 tp10 -65.18 -36.18 83.39 Favored 'General case' 0 C--O 1.233 0.227 0 N-CA-C 113.419 0.896 . . . . 0.0 113.419 -177.137 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 30.3 t70 -67.83 -40.88 83.73 Favored 'General case' 0 CA--C 1.517 -0.322 0 N-CA-C 109.894 -0.41 . . . . 0.0 109.894 179.112 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 9.4 t -75.7 -14.05 60.33 Favored 'General case' 0 N--CA 1.452 -0.326 0 CA-C-N 115.784 -0.643 . . . . 0.0 111.68 -179.337 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 71.92 39.89 58.39 Favored Glycine 0 CA--C 1.526 0.733 0 N-CA-C 108.955 -1.658 . . . . 0.0 108.955 -178.876 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 84.2 mt -128.32 137.1 51.79 Favored 'General case' 0 N--CA 1.448 -0.552 0 N-CA-C 103.109 -2.922 . . . . 0.0 103.109 179.021 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 5.7 t -70.6 155.67 40.44 Favored 'General case' 0 C--N 1.319 -0.728 0 N-CA-C 106.053 -1.832 . . . . 0.0 106.053 178.226 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 74.3 t -52.73 -40.93 36.79 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.452 0 O-C-N 121.033 -1.042 . . . . 0.0 111.988 -179.601 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 65.3 p -61.97 -46.85 87.44 Favored 'General case' 0 N--CA 1.468 0.431 0 CA-C-N 119.494 1.043 . . . . 0.0 110.921 -179.855 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.88 -45.04 91.16 Favored 'General case' 0 C--O 1.219 -0.51 0 N-CA-C 108.238 -1.023 . . . . 0.0 108.238 178.311 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 92.5 t80 -54.35 -48.85 70.96 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 123.806 0.842 . . . . 0.0 109.928 -179.835 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 5.1 mm -56.45 -65.32 0.4 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.241 0 C-N-CA 125.051 1.34 . . . . 0.0 110.88 179.667 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 10.6 ptt180 -57.53 -39.96 77.74 Favored 'General case' 0 C--O 1.22 -0.463 0 CA-C-O 118.898 -0.572 . . . . 0.0 110.442 -178.833 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 8.9 t30 -58.31 -56.98 15.09 Favored 'General case' 0 N--CA 1.453 -0.277 0 C-N-CA 124.07 0.948 . . . . 0.0 109.298 179.432 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -60.11 -34.2 73.17 Favored 'General case' 0 CA--C 1.532 0.264 0 CA-C-O 121.362 0.601 . . . . 0.0 111.132 -179.797 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -67.74 -26.84 66.34 Favored 'General case' 0 CA--C 1.538 0.508 0 O-C-N 121.283 -0.886 . . . . 0.0 113.187 -179.885 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 6.1 mt -100.4 -31.59 11.24 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-N 119.32 0.964 . . . . 0.0 112.069 -178.652 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 38.4 m-80 . . . . . 0 C--O 1.247 0.958 0 C-N-CA 124.712 1.205 . . . . 0.0 108.134 179.583 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 6.0 t . . . . . 0 N--CA 1.437 -1.09 0 N-CA-C 107.066 -1.457 . . . . 0.0 107.066 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 2.4 t -101.07 154.39 4.68 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.911 0 N-CA-C 103.77 -2.678 . . . . 0.0 103.77 177.278 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 11.2 p -145.81 115.39 1.56 Allowed 'Isoleucine or valine' 0 N--CA 1.444 -0.73 0 N-CA-C 106.524 -1.658 . . . . 0.0 106.524 179.468 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 49.0 ttm-85 -152.96 161.19 42.84 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.615 0.721 . . . . 0.0 110.721 -179.63 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -96.92 110.88 23.3 Favored 'General case' 0 N--CA 1.446 -0.646 0 N-CA-C 105.484 -2.043 . . . . 0.0 105.484 179.219 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -109.17 108.89 19.7 Favored 'General case' 0 C--O 1.236 0.357 0 N-CA-C 106.537 -1.653 . . . . 0.0 106.537 -179.887 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 5.7 mtp180 -87.37 153.28 21.57 Favored 'General case' 0 C--N 1.334 -0.065 0 C-N-CA 122.73 0.412 . . . . 0.0 110.254 -179.916 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 22' ' ' PHE . . . . . . . . . . . . . 87.7 m-85 -141.2 143.77 34.39 Favored 'General case' 0 N--CA 1.468 0.471 0 N-CA-C 107.97 -1.122 . . . . 0.0 107.97 179.921 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 1.2 m -74.1 167.03 39.41 Favored Pre-proline 0 CA--C 1.538 0.499 0 CA-C-O 118.254 -0.879 . . . . 0.0 108.986 179.882 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 24' ' ' PRO . . . . . . . . . . . . . 61.0 Cg_endo -67.97 -33.2 26.71 Favored 'Trans proline' 0 C--N 1.346 0.427 0 C-N-CA 121.91 1.74 . . . . 0.0 112.283 -179.181 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 25' ' ' VAL . . . . . . . . . . . . . 61.9 t -64.8 -52.02 59.61 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.413 0 N-CA-C 107.847 -1.168 . . . . 0.0 107.847 179.637 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 1.4 mp0 -63.32 -44.55 94.62 Favored 'General case' 0 C--O 1.222 -0.368 0 C-N-CA 124.156 0.982 . . . . 0.0 110.477 179.276 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 27' ' ' ASP . . . . . . . . . . . . . 6.7 t70 -57.13 -45.22 83.67 Favored 'General case' 0 C--O 1.223 -0.298 0 C-N-CA 125.714 1.606 . . . . 0.0 111.446 -179.685 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 28' ' ' GLU . . . . . . . . . . . . . 46.3 tt0 -63.42 -46.52 85.98 Favored 'General case' 0 N--CA 1.448 -0.549 0 N-CA-C 108.614 -0.884 . . . . 0.0 108.614 178.866 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 52.0 m -62.27 -47.87 82.43 Favored 'General case' 0 C--N 1.333 -0.11 0 O-C-N 121.695 -0.628 . . . . 0.0 110.524 179.226 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 79.2 mt -63.37 -38.4 82.07 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.634 0 CA-C-O 122.415 1.102 . . . . 0.0 108.399 179.759 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 70.0 ttt180 -64.66 -38.3 90.52 Favored 'General case' 0 C--N 1.327 -0.378 0 O-C-N 118.881 -2.387 . . . . 0.0 109.29 178.226 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -71.8 -48.22 47.94 Favored 'General case' 0 C--N 1.33 -0.262 0 C-N-CA 123.937 0.895 . . . . 0.0 112.462 -179.151 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 12.7 mptt -66.45 -46.11 77.53 Favored 'General case' 0 C--O 1.225 -0.221 0 CA-C-O 118.026 -0.988 . . . . 0.0 108.604 -179.857 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 34' ' ' ALA . . . . . . . . . . . . . . . -53.7 -56.31 18.45 Favored 'General case' 0 CA--C 1.528 0.123 0 CA-C-N 119.317 0.962 . . . . 0.0 110.183 179.284 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 5.2 tp10 -63.17 -39.28 94.19 Favored 'General case' 0 C--O 1.232 0.153 0 N-CA-C 112.578 0.585 . . . . 0.0 112.578 -178.303 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 36' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -69.3 -35.57 76.12 Favored 'General case' 0 N--CA 1.46 0.055 0 CA-C-N 118.453 0.57 . . . . 0.0 110.355 179.622 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 37' ' ' SER . . . . . . . . . . . . . 13.9 t -75.92 -12.14 60.09 Favored 'General case' 0 CA--C 1.541 0.628 0 N-CA-C 108.911 -0.774 . . . . 0.0 108.911 178.234 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 75.44 29.6 59.68 Favored Glycine 0 C--N 1.339 0.696 0 O-C-N 121.126 -0.984 . . . . 0.0 110.74 -179.504 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 39' ' ' LEU . . . . . . . . . . . . . 87.6 mt -120.9 159.05 26.32 Favored 'General case' 0 N--CA 1.445 -0.71 0 C-N-CA 125.469 1.508 . . . . 0.0 107.929 179.425 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 40' ' ' THR . . . . . 0.495 HG23 ' H ' ' B' ' 43' ' ' ALA . 1.6 t -81.39 151.9 27.71 Favored 'General case' 0 C--N 1.322 -0.609 0 N-CA-C 104.109 -2.552 . . . . 0.0 104.109 176.799 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 41' ' ' VAL . . . . . . . . . . . . . 42.2 t -48.17 -42.09 10.73 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.659 0 C-N-CA 125.217 1.407 . . . . 0.0 109.627 178.516 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 42' ' ' SER . . . . . . . . . . . . . 13.2 p -60.37 -51.08 71.04 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-N 119.648 1.113 . . . . 0.0 111.39 179.465 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 43' ' ' ALA . . . . . 0.495 ' H ' HG23 ' B' ' 40' ' ' THR . . . -61.04 -42.85 99.25 Favored 'General case' 0 C--O 1.223 -0.302 0 C-N-CA 123.601 0.761 . . . . 0.0 109.023 179.193 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 44' ' ' TYR . . . . . . . . . . . . . 46.8 t80 -58.39 -50.63 72.98 Favored 'General case' 0 N--CA 1.445 -0.709 0 N-CA-C 109.444 -0.576 . . . . 0.0 109.444 179.486 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 45' ' ' ILE . . . . . . . . . . . . . 22.7 mm -55.44 -61.03 1.21 Allowed 'Isoleucine or valine' 0 C--N 1.34 0.189 0 C-N-CA 124.036 0.934 . . . . 0.0 110.214 179.762 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 46' ' ' ARG . . . . . . . . . . . . . 26.9 ptt180 -53.92 -49.11 69.37 Favored 'General case' 0 C--O 1.223 -0.33 0 CA-C-O 118.967 -0.54 . . . . 0.0 111.384 -178.566 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 47' ' ' ASN . . . . . . . . . . . . . 24.0 t30 -60.34 -51.76 68.14 Favored 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 124.195 0.998 . . . . 0.0 112.692 -179.075 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -61.45 -35.57 77.97 Favored 'General case' 0 C--O 1.222 -0.344 0 O-C-N 123.82 0.7 . . . . 0.0 111.528 -179.858 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 49' ' ' ALA . . . . . . . . . . . . . . . -77.07 -24.25 51.92 Favored 'General case' 0 N--CA 1.447 -0.595 0 N-CA-C 113.575 0.954 . . . . 0.0 113.575 -178.79 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 24.8 mt -84.96 -40.75 16.58 Favored 'General case' 0 CA--C 1.513 -0.47 0 CA-C-N 118.734 0.697 . . . . 0.0 111.172 -179.671 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 51' ' ' ASN . . . . . . . . . . . . . 69.5 m-80 . . . . . 0 C--O 1.247 0.924 0 CA-C-O 116.301 -1.809 . . . . 0.0 108.952 179.808 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 5.3 t . . . . . 0 N--CA 1.432 -1.364 0 N-CA-C 108.457 -0.942 . . . . 0.0 108.457 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 16.0 t -101.77 157.61 4.46 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.578 0 N-CA-C 106.445 -1.687 . . . . 0.0 106.445 178.611 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 7.2 p -151.16 107.58 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 N-CA-C 105.723 -1.954 . . . . 0.0 105.723 178.05 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 4.2 ttt85 -152.66 146.63 25.31 Favored 'General case' 0 C--O 1.235 0.334 0 O-C-N 122.085 -0.385 . . . . 0.0 111.669 -178.954 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -76.97 119.03 20.14 Favored 'General case' 0 N--CA 1.449 -0.484 0 N-CA-C 104.739 -2.319 . . . . 0.0 104.739 177.212 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 13.0 tp -123.62 113.14 18.28 Favored 'General case' 0 N--CA 1.442 -0.835 0 C-N-CA 123.275 0.63 . . . . 0.0 109.371 179.788 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 7.7 mtm180 -98.31 162.24 13.28 Favored 'General case' 0 N--CA 1.453 -0.281 0 C-N-CA 125.629 1.572 . . . . 0.0 111.384 179.846 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 78.0 m-85 -144.24 150.99 38.81 Favored 'General case' 0 CA--C 1.53 0.208 0 C-N-CA 125.817 1.647 . . . . 0.0 107.004 179.421 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -75.26 175.43 4.08 Favored Pre-proline 0 CA--C 1.551 1.012 0 CA-C-N 119.83 1.195 . . . . 0.0 108.859 179.329 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 43.6 Cg_endo -66.71 -43.38 7.43 Favored 'Trans proline' 0 C--N 1.35 0.634 0 CA-C-N 122.144 1.802 . . . . 0.0 113.067 -178.67 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 96.3 t -64.38 -41.71 93.17 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.218 0 N-CA-C 108.615 -0.883 . . . . 0.0 108.615 179.893 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -63.39 -47.75 80.73 Favored 'General case' 0 N--CA 1.452 -0.364 0 C-N-CA 123.664 0.785 . . . . 0.0 109.284 179.911 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 5.5 t70 -59.71 -49.91 75.91 Favored 'General case' 0 CA--C 1.507 -0.688 0 C-N-CA 125.837 1.655 . . . . 0.0 111.847 -179.898 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -62.29 -44.41 96.59 Favored 'General case' 0 N--CA 1.447 -0.613 0 N-CA-C 108.123 -1.066 . . . . 0.0 108.123 -179.64 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 30.8 m -61.17 -53.36 57.94 Favored 'General case' 0 N--CA 1.454 -0.265 0 N-CA-C 108.698 -0.852 . . . . 0.0 108.698 178.872 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 58.1 mt -58.16 -43.61 85.93 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.329 0 CA-C-N 119.038 0.835 . . . . 0.0 110.211 -179.644 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 23.2 ttt180 -63.22 -47.67 81.53 Favored 'General case' 0 C--N 1.332 -0.161 0 O-C-N 121.457 -0.777 . . . . 0.0 110.089 179.91 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 4.7 mptp? -63.71 -46.4 85.61 Favored 'General case' 0 C--O 1.225 -0.229 0 CA-C-N 118.82 0.736 . . . . 0.0 109.796 -179.786 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 13.5 mptt -64.82 -44.67 89.11 Favored 'General case' 0 CA--C 1.529 0.143 0 CA-C-O 118.057 -0.973 . . . . 0.0 110.237 -179.566 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -57.37 -56.14 25.67 Favored 'General case' 0 C--O 1.231 0.1 0 C-N-CA 124.656 1.183 . . . . 0.0 109.609 179.018 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 29.9 tt0 -60.63 -40.9 93.67 Favored 'General case' 0 N--CA 1.449 -0.488 0 C-N-CA 123.633 0.773 . . . . 0.0 112.132 -178.269 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 27.6 t70 -68.3 -30.27 69.22 Favored 'General case' 0 CA--C 1.53 0.173 0 C-N-CA 124.349 1.06 . . . . 0.0 110.138 179.449 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 10.1 t -82.18 -6.41 59.18 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 124.58 1.152 . . . . 0.0 109.375 178.153 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 69.2 29.27 72.12 Favored Glycine 0 CA--C 1.527 0.789 0 O-C-N 120.581 -1.325 . . . . 0.0 109.991 -179.265 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 75.9 mt -122.68 158.83 29.2 Favored 'General case' 0 N--CA 1.447 -0.597 0 C-N-CA 125.836 1.654 . . . . 0.0 108.137 179.99 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . 0.427 HG23 ' H ' ' A' ' 43' ' ' ALA . 0.7 OUTLIER -84.91 147.49 26.73 Favored 'General case' 0 C--N 1.32 -0.704 0 N-CA-C 104.036 -2.579 . . . . 0.0 104.036 177.235 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 39.8 t -46.8 -41.05 5.06 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.478 0 C-N-CA 125.356 1.463 . . . . 0.0 110.241 178.494 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -60.75 -49.44 77.48 Favored 'General case' 0 CA--C 1.548 0.873 0 CA-C-N 119.622 1.101 . . . . 0.0 110.587 179.515 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.427 ' H ' HG23 ' A' ' 40' ' ' THR . . . -64.47 -41.84 96.26 Favored 'General case' 0 C--O 1.224 -0.261 0 C-N-CA 125.229 1.411 . . . . 0.0 110.203 178.898 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 81.3 t80 -58.35 -52.54 65.19 Favored 'General case' 0 N--CA 1.452 -0.347 0 N-CA-C 108.087 -1.079 . . . . 0.0 108.087 179.256 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.461 HG23 HG23 ' B' ' 45' ' ' ILE . 16.6 mm -52.44 -59.8 1.4 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.298 0 C-N-CA 124.227 1.011 . . . . 0.0 110.698 179.499 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 29.5 ptt180 -59.05 -44.17 91.76 Favored 'General case' 0 C--O 1.222 -0.381 0 CA-C-O 118.72 -0.657 . . . . 0.0 112.304 -178.944 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 29.4 t30 -59.91 -52.35 65.8 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-N 118.657 0.662 . . . . 0.0 110.808 -178.922 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -62.99 -29.21 70.64 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 123.649 0.78 . . . . 0.0 111.502 179.438 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -80.5 -15.41 56.77 Favored 'General case' 0 CA--C 1.532 0.283 0 N-CA-C 113.791 1.034 . . . . 0.0 113.791 -179.677 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 31.0 mt -101.96 -42.89 5.95 Favored 'General case' 0 CA--C 1.522 -0.131 0 CA-C-N 120.173 1.351 . . . . 0.0 112.124 -179.606 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 60.8 m-80 . . . . . 0 C--O 1.245 0.836 0 O-C-N 124.159 0.912 . . . . 0.0 109.487 -179.437 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 5.4 t . . . . . 0 N--CA 1.436 -1.126 0 CA-C-O 122.234 1.016 . . . . 0.0 109.73 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 23.2 t -122.85 143.82 34.45 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.615 0 N-CA-C 105.537 -2.023 . . . . 0.0 105.537 179.234 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 6.4 p -143.74 97.66 0.58 Allowed 'Isoleucine or valine' 0 N--CA 1.443 -0.784 0 CA-C-O 122.471 1.129 . . . . 0.0 109.564 178.761 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 1.2 ttt85 -144.18 155.05 43.74 Favored 'General case' 0 N--CA 1.45 -0.463 0 CA-C-N 114.617 -1.174 . . . . 0.0 108.372 179.292 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -90.87 134.76 34.21 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 104.096 -2.557 . . . . 0.0 104.096 177.559 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 20' ' ' LEU . . . . . 0.407 ' HA ' HD12 ' B' ' 20' ' ' LEU . 11.3 tp -116.04 154.92 29.04 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-N 118.883 0.765 . . . . 0.0 109.673 179.497 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 18.4 mmt180 -126.54 150.28 48.89 Favored 'General case' 0 C--O 1.232 0.17 0 C-N-CA 125.762 1.625 . . . . 0.0 110.203 -178.93 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 22' ' ' PHE . . . . . . . . . . . . . 91.9 m-85 -145.82 143.91 29.94 Favored 'General case' 0 C--O 1.232 0.165 0 C-N-CA 125.587 1.555 . . . . 0.0 107.366 178.578 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 23' ' ' SER . . . . . 0.402 ' HB3' ' HD2' ' B' ' 24' ' ' PRO . 2.4 m -68.99 170.84 7.57 Favored Pre-proline 0 CA--C 1.542 0.652 0 CA-C-N 119.258 0.935 . . . . 0.0 109.997 179.323 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 24' ' ' PRO . . . . . 0.402 ' HD2' ' HB3' ' B' ' 23' ' ' SER . 36.8 Cg_endo -65.75 -44.81 7.43 Favored 'Trans proline' 0 C--N 1.349 0.584 0 C-N-CA 121.452 1.435 . . . . 0.0 113.139 -178.277 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 25' ' ' VAL . . . . . . . . . . . . . 21.8 t -65.87 -38.99 83.43 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.52 0 C-N-CA 123.918 0.887 . . . . 0.0 109.387 179.788 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 98.6 mt-10 -66.5 -40.93 89.52 Favored 'General case' 0 C--O 1.226 -0.173 0 C-N-CA 123.879 0.872 . . . . 0.0 108.858 179.488 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 27' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -62.89 -50.26 71.6 Favored 'General case' 0 CA--C 1.514 -0.412 0 C-N-CA 123.903 0.881 . . . . 0.0 109.518 179.195 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 28' ' ' GLU . . . . . . . . . . . . . 91.4 mt-10 -57.02 -43.35 81.78 Favored 'General case' 0 C--N 1.332 -0.191 0 C-N-CA 124.245 1.018 . . . . 0.0 109.542 178.689 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 80.0 m -63.23 -59.92 4.09 Favored 'General case' 0 N--CA 1.451 -0.421 0 N-CA-C 109.599 -0.519 . . . . 0.0 109.599 179.52 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 98.0 mt -58.09 -39.07 71.03 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.449 0 C-N-CA 123.961 0.904 . . . . 0.0 111.891 -178.686 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 24.1 ttt-85 -67.08 -48.4 68.34 Favored 'General case' 0 N--CA 1.453 -0.277 0 O-C-N 121.399 -0.813 . . . . 0.0 108.977 -179.855 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 2.1 mptp? -60.94 -46.98 88.52 Favored 'General case' 0 CA--C 1.515 -0.386 0 N-CA-C 108.82 -0.807 . . . . 0.0 108.82 -179.89 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 58.7 mmtt -63.59 -43.91 95.56 Favored 'General case' 0 C--O 1.22 -0.448 0 CA-C-O 118.053 -0.975 . . . . 0.0 110.619 -179.498 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 34' ' ' ALA . . . . . . . . . . . . . . . -58.21 -50.94 71.79 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 119.6 1.091 . . . . 0.0 109.237 178.618 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 27.6 tt0 -60.06 -45.03 94.23 Favored 'General case' 0 N--CA 1.454 -0.255 0 C-N-CA 124.144 0.977 . . . . 0.0 111.779 -179.185 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 36' ' ' ASP . . . . . . . . . . . . . 25.3 t0 -68.73 -37.53 79.53 Favored 'General case' 0 C--N 1.331 -0.215 0 C-N-CA 125.332 1.453 . . . . 0.0 110.418 -179.362 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 37' ' ' SER . . . . . . . . . . . . . 32.8 t -73.0 -11.2 60.48 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 126.409 1.884 . . . . 0.0 110.04 178.723 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 68.33 26.89 74.02 Favored Glycine 0 CA--C 1.525 0.689 0 O-C-N 121.246 -0.909 . . . . 0.0 111.259 -179.447 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 39' ' ' LEU . . . . . . . . . . . . . 82.2 mt -121.17 142.29 50.03 Favored 'General case' 0 N--CA 1.445 -0.678 0 C-N-CA 125.2 1.4 . . . . 0.0 107.588 -179.717 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 40' ' ' THR . . . . . . . . . . . . . 2.0 t -64.61 146.31 54.86 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 105.367 -2.086 . . . . 0.0 105.367 177.036 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 41' ' ' VAL . . . . . . . . . . . . . 2.2 t -45.94 -51.27 3.65 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.469 0 C-N-CA 124.748 1.219 . . . . 0.0 111.538 179.303 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 42' ' ' SER . . . . . . . . . . . . . 1.5 p -58.09 -31.54 67.21 Favored 'General case' 0 CA--C 1.544 0.741 0 O-C-N 120.325 -1.485 . . . . 0.0 112.686 -179.199 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -78.46 -40.8 34.57 Favored 'General case' 0 C--O 1.224 -0.256 0 C-N-CA 124.694 1.198 . . . . 0.0 109.047 177.71 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 44' ' ' TYR . . . . . . . . . . . . . 24.6 t80 -57.37 -51.85 67.74 Favored 'General case' 0 N--CA 1.455 -0.224 0 N-CA-C 108.409 -0.959 . . . . 0.0 108.409 179.442 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 45' ' ' ILE . . . . . 0.461 HG23 HG23 ' A' ' 45' ' ' ILE . 28.0 mm -54.16 -60.67 1.27 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.309 0 C-N-CA 123.358 0.663 . . . . 0.0 111.676 179.499 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 46' ' ' ARG . . . . . . . . . . . . . 9.9 ptt180 -56.48 -43.19 79.39 Favored 'General case' 0 C--O 1.224 -0.264 0 CA-C-O 119.171 -0.442 . . . . 0.0 111.23 -178.519 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 47' ' ' ASN . . . . . . . . . . . . . 39.0 t30 -60.41 -55.93 27.63 Favored 'General case' 0 N--CA 1.446 -0.642 0 C-N-CA 123.885 0.874 . . . . 0.0 111.944 -179.198 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -60.2 -33.33 72.09 Favored 'General case' 0 CA--C 1.53 0.185 0 O-C-N 124.17 0.919 . . . . 0.0 112.564 -179.069 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 49' ' ' ALA . . . . . . . . . . . . . . . -74.0 -24.33 59.57 Favored 'General case' 0 C--N 1.333 -0.145 0 N-CA-C 113.986 1.106 . . . . 0.0 113.986 -178.929 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 24.0 mt -100.19 -43.13 6.41 Favored 'General case' 0 CA--C 1.514 -0.407 0 N-CA-C 113.423 0.897 . . . . 0.0 113.423 -178.672 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 51' ' ' ASN . . . . . . . . . . . . . 26.6 m-80 . . . . . 0 C--O 1.249 1.062 0 C-N-CA 125.179 1.392 . . . . 0.0 107.649 -177.514 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 4.7 t . . . . . 0 N--CA 1.446 -0.635 0 N-CA-C 107.266 -1.383 . . . . 0.0 107.266 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 13.5 t -131.32 157.98 43.26 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 N-CA-C 106.01 -1.848 . . . . 0.0 106.01 -179.673 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 13.6 p -149.16 116.98 0.9 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.444 0 N-CA-C 106.881 -1.525 . . . . 0.0 106.881 178.898 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 25.1 ttt180 -153.26 161.22 42.63 Favored 'General case' 0 N--CA 1.466 0.339 0 O-C-N 121.691 -0.631 . . . . 0.0 110.153 -179.847 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -106.32 127.79 53.51 Favored 'General case' 0 C--O 1.24 0.58 0 N-CA-C 105.052 -2.203 . . . . 0.0 105.052 179.102 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -128.24 120.31 26.92 Favored 'General case' 0 CA--C 1.529 0.162 0 C-N-CA 124.284 1.034 . . . . 0.0 109.602 -178.448 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 15.6 mmt85 -83.84 156.97 22.2 Favored 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 124.811 1.244 . . . . 0.0 110.665 -179.768 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 70.6 m-85 -144.61 155.31 43.56 Favored 'General case' 0 N--CA 1.463 0.224 0 C-N-CA 125.355 1.462 . . . . 0.0 108.315 178.55 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . 0.457 ' HB3' ' HD2' ' A' ' 24' ' ' PRO . 39.1 m -79.9 171.08 13.34 Favored Pre-proline 0 CA--C 1.545 0.783 0 C-N-CA 123.976 0.91 . . . . 0.0 108.904 179.095 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . 0.457 ' HD2' ' HB3' ' A' ' 23' ' ' SER . 35.0 Cg_endo -64.75 -54.61 0.68 Allowed 'Trans proline' 0 C--N 1.351 0.674 0 C-N-CA 121.961 1.774 . . . . 0.0 112.027 -178.012 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 33.7 t -58.91 -42.02 84.68 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.337 0 C-N-CA 123.359 0.664 . . . . 0.0 110.013 -179.716 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -63.55 -50.24 70.29 Favored 'General case' 0 C--O 1.227 -0.092 0 C-N-CA 123.289 0.635 . . . . 0.0 110.856 -179.576 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 7.1 t70 -59.65 -47.04 87.18 Favored 'General case' 0 C--O 1.221 -0.398 0 C-N-CA 123.859 0.864 . . . . 0.0 110.224 179.218 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 44.8 tt0 -58.18 -44.71 88.15 Favored 'General case' 0 N--CA 1.449 -0.523 0 C-N-CA 124.628 1.171 . . . . 0.0 109.217 179.945 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 68.7 m -60.42 -52.18 66.32 Favored 'General case' 0 CA--C 1.538 0.51 0 N-CA-C 108.793 -0.818 . . . . 0.0 108.793 178.886 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 72.3 mt -59.26 -45.99 92.63 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.211 0 C-N-CA 123.379 0.672 . . . . 0.0 109.752 -179.684 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 62.8 ttt180 -61.06 -40.98 95.7 Favored 'General case' 0 C--O 1.234 0.255 0 C-N-CA 124.237 1.015 . . . . 0.0 110.308 -179.525 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -68.34 -52.65 31.0 Favored 'General case' 0 CA--C 1.52 -0.201 0 CA-C-N 118.644 0.656 . . . . 0.0 110.33 179.461 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 75.9 mttt -60.99 -43.44 98.85 Favored 'General case' 0 CA--C 1.518 -0.262 0 CA-C-N 119.021 0.828 . . . . 0.0 111.122 -178.584 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -56.82 -54.16 49.64 Favored 'General case' 0 N--CA 1.452 -0.337 0 C-N-CA 123.936 0.894 . . . . 0.0 109.477 179.235 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 31.3 tt0 -62.82 -41.46 99.33 Favored 'General case' 0 N--CA 1.455 -0.185 0 N-CA-C 112.908 0.707 . . . . 0.0 112.908 -178.516 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -62.95 -39.3 94.22 Favored 'General case' 0 N--CA 1.453 -0.309 0 C-N-CA 125.451 1.501 . . . . 0.0 108.574 179.449 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 8.7 t -78.89 -9.76 59.59 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 123.815 0.846 . . . . 0.0 109.967 177.776 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 64.71 27.08 71.51 Favored Glycine 0 N--CA 1.442 -0.928 0 C-N-CA 125.955 1.74 . . . . 0.0 112.078 -179.458 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 13.3 mt -118.3 138.1 52.61 Favored 'General case' 0 CA--C 1.518 -0.287 0 N-CA-C 103.851 -2.648 . . . . 0.0 103.851 179.292 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . 0.453 HG23 ' H ' ' A' ' 43' ' ' ALA . 5.5 t -56.4 151.85 12.4 Favored 'General case' 0 CA--C 1.534 0.333 0 N-CA-C 108.968 -0.753 . . . . 0.0 108.968 178.942 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 24.4 t -52.14 -37.1 21.57 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.363 0 N-CA-C 109.106 -0.702 . . . . 0.0 109.106 177.865 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 12.2 m -62.09 -30.46 71.02 Favored 'General case' 0 CA--C 1.541 0.605 0 O-C-N 121.138 -0.976 . . . . 0.0 112.646 179.893 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.453 ' H ' HG23 ' A' ' 40' ' ' THR . . . -81.82 -46.51 14.07 Favored 'General case' 0 CA--C 1.516 -0.356 0 N-CA-C 106.535 -1.654 . . . . 0.0 106.535 177.852 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 82.0 t80 -51.39 -52.68 43.71 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 124.091 0.956 . . . . 0.0 109.327 -179.684 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 13.1 mm -53.0 -64.01 0.43 Allowed 'Isoleucine or valine' 0 C--N 1.34 0.173 0 C-N-CA 126.079 1.752 . . . . 0.0 110.801 179.479 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -54.61 -47.95 72.78 Favored 'General case' 0 C--O 1.22 -0.487 0 CA-C-O 119.133 -0.461 . . . . 0.0 111.305 -178.2 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 11.3 t30 -58.76 -49.79 76.35 Favored 'General case' 0 N--CA 1.445 -0.713 0 C-N-CA 123.455 0.702 . . . . 0.0 112.427 -178.877 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -64.98 -31.97 73.46 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 123.388 0.675 . . . . 0.0 111.146 179.337 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -75.86 -35.65 59.85 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 124.156 0.982 . . . . 0.0 113.05 -179.742 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.454 HD21 ' HA ' ' B' ' 26' ' ' GLU . 22.5 mt -77.54 -44.56 28.18 Favored 'General case' 0 CA--C 1.515 -0.398 0 N-CA-C 113.817 1.043 . . . . 0.0 113.817 -177.81 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 57.9 m-80 . . . . . 0 C--O 1.249 1.047 0 CA-C-O 117.774 -1.108 . . . . 0.0 111.233 179.632 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 2.9 t . . . . . 0 N--CA 1.445 -0.713 0 N-CA-C 107.391 -1.337 . . . . 0.0 107.391 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 2.9 t -141.02 154.54 21.1 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.719 0 N-CA-C 106.432 -1.692 . . . . 0.0 106.432 179.24 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 14.0 p -141.53 114.51 4.37 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.646 0 N-CA-C 106.725 -1.583 . . . . 0.0 106.725 178.579 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 7.9 ttt180 -149.26 148.56 29.71 Favored 'General case' 0 N--CA 1.47 0.553 0 N-CA-C 108.166 -1.05 . . . . 0.0 108.166 178.691 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 2.6 m -101.2 116.66 33.33 Favored 'General case' 0 C--O 1.236 0.376 0 N-CA-C 107.982 -1.118 . . . . 0.0 107.982 -179.614 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -115.28 159.96 20.36 Favored 'General case' 0 C--O 1.235 0.296 0 C-N-CA 124.412 1.085 . . . . 0.0 109.97 -179.508 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 1.5 mtt85 -125.99 162.9 24.19 Favored 'General case' 0 N--CA 1.443 -0.787 0 C-N-CA 124.711 1.204 . . . . 0.0 110.721 178.439 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 22' ' ' PHE . . . . . . . . . . . . . 92.9 m-85 -140.65 146.66 38.18 Favored 'General case' 0 N--CA 1.454 -0.27 0 C-N-CA 124.985 1.314 . . . . 0.0 107.996 179.749 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 14.8 m -73.91 168.75 23.06 Favored Pre-proline 0 CA--C 1.548 0.887 0 N-CA-C 106.714 -1.587 . . . . 0.0 106.714 178.276 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 24' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_endo -63.0 -44.27 16.41 Favored 'Trans proline' 0 N--CA 1.459 -0.523 0 C-N-CA 121.456 1.437 . . . . 0.0 112.825 -178.112 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 25' ' ' VAL . . . . . . . . . . . . . 75.1 t -64.87 -40.22 88.33 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.276 0 C-N-CA 123.894 0.878 . . . . 0.0 110.168 179.609 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 26' ' ' GLU . . . . . 0.454 ' HA ' HD21 ' A' ' 50' ' ' LEU . 81.9 mt-10 -62.76 -51.05 68.66 Favored 'General case' 0 N--CA 1.453 -0.316 0 N-CA-C 109.494 -0.558 . . . . 0.0 109.494 -179.343 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 27' ' ' ASP . . . . . . . . . . . . . 17.7 t70 -59.28 -47.48 85.2 Favored 'General case' 0 CA--C 1.511 -0.543 0 C-N-CA 125.165 1.386 . . . . 0.0 111.428 179.875 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 28' ' ' GLU . . . . . . . . . . . . . 73.2 tt0 -57.6 -46.91 83.46 Favored 'General case' 0 N--CA 1.447 -0.594 0 C-N-CA 124.589 1.156 . . . . 0.0 109.108 179.421 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 55.9 m -61.82 -57.86 10.22 Favored 'General case' 0 CA--C 1.533 0.323 0 N-CA-C 109.618 -0.512 . . . . 0.0 109.618 179.067 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 90.2 mt -53.92 -46.13 64.19 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.1 0 C-N-CA 123.539 0.736 . . . . 0.0 110.671 -178.066 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 63.0 ttt180 -61.14 -47.92 83.98 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-O 118.688 -0.672 . . . . 0.0 110.72 -179.665 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -65.24 -46.32 81.04 Favored 'General case' 0 CA--C 1.517 -0.302 0 CA-C-O 118.617 -0.706 . . . . 0.0 110.214 -179.073 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 65.1 mttt -59.22 -47.82 83.93 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-N 118.935 0.789 . . . . 0.0 110.276 -179.497 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 34' ' ' ALA . . . . . . . . . . . . . . . -57.86 -56.45 21.82 Favored 'General case' 0 N--CA 1.45 -0.457 0 C-N-CA 124.229 1.011 . . . . 0.0 110.248 179.802 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 17.4 tt0 -62.94 -34.6 77.82 Favored 'General case' 0 C--N 1.33 -0.253 0 C-N-CA 123.796 0.839 . . . . 0.0 112.783 -177.681 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 36' ' ' ASP . . . . . . . . . . . . . 5.3 t70 -67.94 -42.36 81.12 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 108.263 -1.014 . . . . 0.0 108.263 178.715 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 37' ' ' SER . . . . . . . . . . . . . 31.8 t -71.98 -27.0 62.47 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-O 121.244 0.545 . . . . 0.0 109.861 179.412 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 97.72 -4.05 61.26 Favored Glycine 0 CA--C 1.523 0.541 0 C-N-CA 125.203 1.382 . . . . 0.0 111.877 -179.712 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 39' ' ' LEU . . . . . . . . . . . . . 31.8 mt -87.85 144.29 26.67 Favored 'General case' 0 N--CA 1.438 -1.038 0 C-N-CA 125.255 1.422 . . . . 0.0 107.168 -179.959 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 40' ' ' THR . . . . . . . . . . . . . 1.8 t -68.39 147.25 52.35 Favored 'General case' 0 C--N 1.313 -0.988 0 N-CA-C 106.039 -1.837 . . . . 0.0 106.039 177.56 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 41' ' ' VAL . . . . . . . . . . . . . 53.7 t -49.88 -38.26 13.77 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.446 0 O-C-N 121.524 -0.735 . . . . 0.0 110.926 179.144 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 42' ' ' SER . . . . . . . . . . . . . 14.1 p -61.67 -37.78 85.33 Favored 'General case' 0 CA--C 1.533 0.327 0 O-C-N 121.071 -1.018 . . . . 0.0 111.836 179.651 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -73.73 -43.3 59.54 Favored 'General case' 0 C--N 1.341 0.211 0 C-N-CA 125.802 1.641 . . . . 0.0 108.3 178.492 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 44' ' ' TYR . . . . . . . . . . . . . 47.2 t80 -56.08 -50.01 72.2 Favored 'General case' 0 N--CA 1.451 -0.378 0 C-N-CA 123.721 0.809 . . . . 0.0 109.323 179.489 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 45' ' ' ILE . . . . . . . . . . . . . 12.8 mm -52.56 -63.93 0.43 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.291 0 C-N-CA 124.786 1.235 . . . . 0.0 110.727 179.765 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 46' ' ' ARG . . . . . . . . . . . . . 15.2 ptp180 -55.36 -48.06 74.83 Favored 'General case' 0 C--O 1.226 -0.161 0 C-N-CA 123.602 0.761 . . . . 0.0 112.081 -179.5 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 47' ' ' ASN . . . . . . . . . . . . . 29.9 t30 -59.42 -53.17 61.19 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-O 118.717 -0.659 . . . . 0.0 111.141 -179.347 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -63.28 -32.76 74.26 Favored 'General case' 0 C--O 1.224 -0.24 0 C-N-CA 123.753 0.821 . . . . 0.0 112.283 -179.574 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 49' ' ' ALA . . . . . . . . . . . . . . . -68.62 -37.03 79.42 Favored 'General case' 0 C--O 1.232 0.167 0 O-C-N 121.758 -0.589 . . . . 0.0 111.145 179.931 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 21.4 mt -79.8 -41.36 26.62 Favored 'General case' 0 CA--C 1.521 -0.147 0 CA-C-O 119.1 -0.476 . . . . 0.0 110.439 -179.687 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 51' ' ' ASN . . . . . . . . . . . . . 57.5 m-80 . . . . . 0 C--O 1.253 1.286 0 C-N-CA 124.335 1.054 . . . . 0.0 111.295 -178.492 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 4.0 t . . . . . 0 N--CA 1.446 -0.637 0 CA-C-O 121.769 0.795 . . . . 0.0 108.883 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 2.4 t -119.05 156.48 21.12 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 C-N-CA 125.954 1.701 . . . . 0.0 106.623 178.485 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 14.8 p -144.47 123.47 6.72 Favored 'Isoleucine or valine' 0 C--O 1.238 0.499 0 N-CA-C 106.73 -1.582 . . . . 0.0 106.73 178.928 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 13.7 ttm180 -154.51 164.92 37.95 Favored 'General case' 0 C--O 1.234 0.266 0 O-C-N 121.674 -0.641 . . . . 0.0 109.516 179.416 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 3.8 m -107.84 135.32 49.44 Favored 'General case' 0 N--CA 1.448 -0.542 0 N-CA-C 105.327 -2.101 . . . . 0.0 105.327 178.721 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 43.9 mt -129.91 108.76 10.37 Favored 'General case' 0 CA--C 1.512 -0.513 0 N-CA-C 108.584 -0.895 . . . . 0.0 108.584 179.293 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -77.86 150.32 34.19 Favored 'General case' 0 N--CA 1.45 -0.462 0 N-CA-C 107.213 -1.403 . . . . 0.0 107.213 177.555 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 66.6 m-85 -144.02 161.74 38.0 Favored 'General case' 0 C--O 1.237 0.433 0 N-CA-C 106.508 -1.664 . . . . 0.0 106.508 178.185 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . 0.413 ' HB3' ' HD2' ' A' ' 24' ' ' PRO . 36.7 m -92.71 167.6 14.21 Favored Pre-proline 0 CA--C 1.538 0.483 0 C-N-CA 124.58 1.152 . . . . 0.0 109.407 179.453 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . 0.413 ' HD2' ' HB3' ' A' ' 23' ' ' SER . 55.4 Cg_endo -63.01 -29.81 75.82 Favored 'Trans proline' 0 C--N 1.347 0.45 0 C-N-CA 122.861 2.374 . . . . 0.0 113.306 -178.808 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 71.6 t -68.63 -54.61 19.99 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.455 0 N-CA-C 107.381 -1.34 . . . . 0.0 107.381 179.134 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 28.0 mt-10 -59.45 -44.08 93.04 Favored 'General case' 0 C--O 1.223 -0.302 0 C-N-CA 125.231 1.412 . . . . 0.0 110.58 179.964 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -62.13 -48.54 79.69 Favored 'General case' 0 CA--C 1.512 -0.489 0 C-N-CA 125.667 1.587 . . . . 0.0 110.919 179.984 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 76.7 tt0 -59.69 -42.4 92.89 Favored 'General case' 0 N--CA 1.453 -0.284 0 N-CA-C 108.509 -0.923 . . . . 0.0 108.509 178.486 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 18.8 m -62.26 -60.31 3.77 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 123.461 0.704 . . . . 0.0 109.559 -179.932 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 96.5 mt -57.87 -39.54 71.83 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.163 0 C-N-CA 124.195 0.998 . . . . 0.0 111.064 -178.965 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 19.8 ttt180 -69.36 -37.11 77.46 Favored 'General case' 0 C--N 1.332 -0.186 0 O-C-N 120.907 -1.12 . . . . 0.0 110.675 -179.81 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 2.2 mptp? -70.15 -49.24 52.55 Favored 'General case' 0 CA--C 1.517 -0.29 0 N-CA-C 109.385 -0.598 . . . . 0.0 109.385 178.973 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 3.2 mptp? -63.81 -46.48 84.97 Favored 'General case' 0 CA--C 1.511 -0.521 0 C-N-CA 124.478 1.111 . . . . 0.0 110.682 -178.462 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -59.27 -53.96 52.3 Favored 'General case' 0 N--CA 1.452 -0.368 0 CA-C-N 119.137 0.881 . . . . 0.0 109.794 179.611 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 41.9 tt0 -62.45 -38.06 88.3 Favored 'General case' 0 CA--C 1.532 0.282 0 N-CA-C 112.011 0.374 . . . . 0.0 112.011 -178.099 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 31.6 t70 -69.64 -37.95 76.97 Favored 'General case' 0 C--O 1.233 0.228 0 C-N-CA 123.535 0.734 . . . . 0.0 109.878 179.194 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 10.4 t -72.37 -8.04 52.84 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 124.224 1.01 . . . . 0.0 108.639 177.802 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 71.03 6.72 60.99 Favored Glycine 0 C--N 1.341 0.86 0 C-N-CA 126.098 1.808 . . . . 0.0 113.108 -179.488 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 15.3 mt -101.66 161.05 13.93 Favored 'General case' 0 N--CA 1.441 -0.888 0 C-N-CA 126.161 1.784 . . . . 0.0 107.127 -179.491 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . 0.496 HG23 ' H ' ' A' ' 43' ' ' ALA . 5.1 t -81.04 155.16 26.48 Favored 'General case' 0 C--N 1.313 -1.012 0 O-C-N 120.42 -1.425 . . . . 0.0 107.641 178.781 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 20.8 t -51.65 -39.75 24.41 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.407 0 C-N-CA 124.87 1.268 . . . . 0.0 110.099 178.659 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 15.2 p -61.44 -50.46 72.7 Favored 'General case' 0 CA--C 1.534 0.35 0 O-C-N 121.907 -0.496 . . . . 0.0 109.987 179.303 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.496 ' H ' HG23 ' A' ' 40' ' ' THR . . . -59.86 -48.84 80.05 Favored 'General case' 0 CA--C 1.519 -0.217 0 C-N-CA 125.737 1.615 . . . . 0.0 109.959 178.997 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 81.9 t80 -51.14 -49.56 60.61 Favored 'General case' 0 N--CA 1.45 -0.47 0 C-N-CA 124.814 1.246 . . . . 0.0 109.803 -179.873 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 13.9 mm -57.67 -65.01 0.46 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.394 0 C-N-CA 124.067 0.947 . . . . 0.0 110.62 179.373 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 7.2 ptp180 -53.81 -41.65 67.54 Favored 'General case' 0 C--N 1.341 0.198 0 CA-C-O 117.886 -1.054 . . . . 0.0 111.906 -178.424 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 28.9 t30 -61.88 -55.89 25.02 Favored 'General case' 0 N--CA 1.453 -0.312 0 C-N-CA 124.014 0.926 . . . . 0.0 110.127 179.68 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -61.5 -29.55 70.05 Favored 'General case' 0 C--O 1.224 -0.248 0 C-N-CA 123.176 0.59 . . . . 0.0 112.288 -179.133 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -77.6 -26.38 50.62 Favored 'General case' 0 N--CA 1.451 -0.412 0 N-CA-C 113.148 0.796 . . . . 0.0 113.148 179.885 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 18.5 mt -88.92 -42.69 11.67 Favored 'General case' 0 CA--C 1.514 -0.413 0 O-C-N 121.031 -1.043 . . . . 0.0 109.346 -179.679 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 5.5 m-80 . . . . . 0 C--O 1.242 0.683 0 O-C-N 124.628 1.205 . . . . 0.0 107.883 179.461 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 1.3 t . . . . . 0 N--CA 1.443 -0.784 0 CA-C-O 122.152 0.977 . . . . 0.0 110.923 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 41.0 t -117.76 146.66 21.94 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 C-N-CA 126.813 2.045 . . . . 0.0 105.902 179.02 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 7.2 p -146.07 107.76 0.77 Allowed 'Isoleucine or valine' 0 N--CA 1.451 -0.418 0 N-CA-C 105.343 -2.095 . . . . 0.0 105.343 178.326 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 9.8 ttt180 -149.52 166.43 29.21 Favored 'General case' 0 CA--C 1.509 -0.633 0 N-CA-C 109.978 -0.378 . . . . 0.0 109.978 -179.739 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 19.2 m -105.49 145.7 30.54 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 108.282 -1.007 . . . . 0.0 108.282 179.699 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 26.7 mt -135.5 143.5 45.84 Favored 'General case' 0 N--CA 1.443 -0.816 0 N-CA-C 106.481 -1.674 . . . . 0.0 106.481 177.405 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -114.91 143.2 45.52 Favored 'General case' 0 N--CA 1.448 -0.526 0 N-CA-C 105.434 -2.061 . . . . 0.0 105.434 178.976 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 22' ' ' PHE . . . . . . . . . . . . . 95.8 m-85 -136.46 140.98 43.5 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 106.145 -1.798 . . . . 0.0 106.145 179.632 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 4.6 m -74.87 169.08 21.76 Favored Pre-proline 0 CA--C 1.543 0.699 0 C-N-CA 123.33 0.652 . . . . 0.0 109.272 179.802 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 24' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo -67.06 -28.92 40.85 Favored 'Trans proline' 0 C--N 1.348 0.525 0 C-N-CA 122.025 1.817 . . . . 0.0 113.573 -178.294 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 25' ' ' VAL . . . . . . . . . . . . . 46.8 t -74.51 -48.34 35.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 N-CA-C 107.38 -1.341 . . . . 0.0 107.38 -179.666 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 26.8 mp0 -59.51 -43.28 93.42 Favored 'General case' 0 N--CA 1.448 -0.566 0 C-N-CA 125.071 1.348 . . . . 0.0 109.206 179.181 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 27' ' ' ASP . . . . . . . . . . . . . 19.3 t70 -63.65 -50.27 69.96 Favored 'General case' 0 C--O 1.224 -0.246 0 C-N-CA 124.252 1.021 . . . . 0.0 109.84 179.136 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 28' ' ' GLU . . . . . . . . . . . . . 64.1 tt0 -60.89 -17.21 49.33 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 125.138 1.375 . . . . 0.0 110.915 179.254 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 27.2 m -91.92 -61.44 1.63 Allowed 'General case' 0 N--CA 1.453 -0.317 0 N-CA-C 107.671 -1.233 . . . . 0.0 107.671 178.427 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 96.4 mt -58.17 -29.34 36.86 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.484 0 C-N-CA 124.109 0.964 . . . . 0.0 112.462 -178.388 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 61.8 ttt180 -73.58 -32.19 64.0 Favored 'General case' 0 C--N 1.328 -0.355 0 O-C-N 120.358 -1.464 . . . . 0.0 110.185 -179.959 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 3.7 mptp? -81.03 -50.51 9.58 Favored 'General case' 0 N--CA 1.456 -0.135 0 C-N-CA 123.584 0.754 . . . . 0.0 112.274 -179.475 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 4.6 mptp? -61.15 -42.06 97.88 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-O 118.95 -0.547 . . . . 0.0 110.785 -177.847 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 34' ' ' ALA . . . . . . . . . . . . . . . -60.1 -54.55 44.56 Favored 'General case' 0 N--CA 1.455 -0.213 0 C-N-CA 124.155 0.982 . . . . 0.0 108.794 179.614 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 16.4 tt0 -61.14 -36.38 79.63 Favored 'General case' 0 CA--C 1.532 0.273 0 N-CA-C 112.435 0.532 . . . . 0.0 112.435 -178.522 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 36' ' ' ASP . . . . . . . . . . . . . 5.8 t70 -70.85 -34.16 71.37 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 124.095 0.958 . . . . 0.0 110.279 178.88 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 37' ' ' SER . . . . . . . . . . . . . 9.6 t -79.69 -6.0 56.32 Favored 'General case' 0 N--CA 1.453 -0.309 0 C-N-CA 124.207 1.003 . . . . 0.0 111.906 179.388 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 68.03 20.55 72.9 Favored Glycine 0 CA--C 1.534 1.237 0 N-CA-C 110.642 -0.983 . . . . 0.0 110.642 -178.299 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 39' ' ' LEU . . . . . . . . . . . . . 55.4 mt -115.61 128.84 56.23 Favored 'General case' 0 CA--C 1.514 -0.413 0 N-CA-C 104.994 -2.224 . . . . 0.0 104.994 179.943 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 40' ' ' THR . . . . . . . . . . . . . 1.2 t -63.38 152.9 36.81 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 107.659 -1.237 . . . . 0.0 107.659 178.987 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 41' ' ' VAL . . . . . . . . . . . . . 40.2 t -47.64 -40.8 7.73 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.638 0 C-N-CA 124.454 1.102 . . . . 0.0 110.455 178.366 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 42' ' ' SER . . . . . . . . . . . . . 9.8 m -63.35 -36.62 84.3 Favored 'General case' 0 CA--C 1.546 0.791 0 O-C-N 119.827 -1.795 . . . . 0.0 111.667 179.809 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -74.82 -45.57 42.52 Favored 'General case' 0 C--O 1.223 -0.294 0 C-N-CA 125.612 1.565 . . . . 0.0 110.687 178.766 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 44' ' ' TYR . . . . . . . . . . . . . 4.1 t80 -55.89 -41.07 73.91 Favored 'General case' 0 CA--C 1.537 0.444 0 CA-C-N 119.158 0.89 . . . . 0.0 109.42 179.527 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 45' ' ' ILE . . . . . . . . . . . . . 13.2 mm -57.63 -64.31 0.55 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.37 0 CA-C-N 118.847 0.749 . . . . 0.0 109.763 178.897 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 46' ' ' ARG . . . . . . . . . . . . . 12.8 ptp180 -56.0 -46.53 78.71 Favored 'General case' 0 C--O 1.219 -0.508 0 CA-C-O 118.257 -0.878 . . . . 0.0 111.368 -179.15 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 47' ' ' ASN . . . . . . . . . . . . . 35.3 t30 -54.69 -54.43 41.92 Favored 'General case' 0 N--CA 1.452 -0.33 0 CA-C-N 118.989 0.813 . . . . 0.0 110.678 -179.557 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -64.13 -29.58 70.69 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 123.82 0.848 . . . . 0.0 112.35 -179.955 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 49' ' ' ALA . . . . . . . . . . . . . . . -78.75 -14.82 59.07 Favored 'General case' 0 CA--C 1.53 0.186 0 C-N-CA 124.372 1.069 . . . . 0.0 113.277 -179.557 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 11.8 mt -112.83 -35.4 5.48 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-N 119.241 0.928 . . . . 0.0 113.15 -179.264 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 51' ' ' ASN . . . . . . . . . . . . . 70.3 m-80 . . . . . 0 CA--C 1.5 -0.978 0 CA-C-O 116.339 -1.791 . . . . 0.0 112.279 -177.503 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 5.8 t . . . . . 0 N--CA 1.444 -0.754 0 CA-C-O 122.323 1.059 . . . . 0.0 108.803 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 20.3 t -96.57 145.39 8.85 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.621 0 N-CA-C 104.603 -2.369 . . . . 0.0 104.603 178.062 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 8.0 p -143.38 107.45 1.23 Allowed 'Isoleucine or valine' 0 C--O 1.238 0.485 0 N-CA-C 104.909 -2.256 . . . . 0.0 104.909 178.295 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 10.0 ttt85 -141.94 162.14 36.21 Favored 'General case' 0 C--O 1.237 0.411 0 CA-C-O 121.423 0.63 . . . . 0.0 111.826 -179.251 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 42.0 m -92.12 103.43 15.92 Favored 'General case' 0 N--CA 1.445 -0.7 0 N-CA-C 105.144 -2.169 . . . . 0.0 105.144 179.503 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.457 HD12 ' HA ' ' A' ' 20' ' ' LEU . 18.6 tp -110.58 111.64 22.99 Favored 'General case' 0 C--N 1.323 -0.553 0 C-N-CA 123.931 0.893 . . . . 0.0 108.75 179.836 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 11.5 mmm-85 -94.51 150.96 19.73 Favored 'General case' 0 N--CA 1.451 -0.38 0 C-N-CA 124.637 1.175 . . . . 0.0 109.879 179.785 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 87.2 m-85 -128.82 179.09 5.91 Favored 'General case' 0 C--O 1.237 0.412 0 C-N-CA 125.853 1.661 . . . . 0.0 108.096 178.457 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . 0.485 ' HB3' ' HD2' ' A' ' 24' ' ' PRO . 62.6 m -112.06 173.94 2.59 Favored Pre-proline 0 CA--C 1.543 0.687 0 CA-C-O 117.563 -1.208 . . . . 0.0 109.041 179.853 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . 0.485 ' HD2' ' HB3' ' A' ' 23' ' ' SER . 45.1 Cg_endo -68.51 -48.9 0.96 Allowed 'Trans proline' 0 C--N 1.35 0.617 0 CA-C-N 121.557 1.592 . . . . 0.0 113.478 -177.15 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 20.4 t -66.17 -37.2 79.21 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.432 0 N-CA-C 109.657 -0.498 . . . . 0.0 109.657 -179.499 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 49.8 mt-10 -64.62 -50.86 65.49 Favored 'General case' 0 C--N 1.341 0.212 0 N-CA-C 108.788 -0.819 . . . . 0.0 108.788 179.636 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 6.0 t70 -57.52 -45.34 85.11 Favored 'General case' 0 CA--C 1.513 -0.463 0 C-N-CA 124.972 1.309 . . . . 0.0 110.617 179.642 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -60.51 -46.19 91.06 Favored 'General case' 0 N--CA 1.45 -0.437 0 C-N-CA 123.296 0.638 . . . . 0.0 109.438 179.703 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 27.8 m -60.7 -57.08 14.2 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 123.179 0.592 . . . . 0.0 109.94 179.671 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 40.5 mt -58.03 -43.13 84.43 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.317 0 C-N-CA 124.927 1.291 . . . . 0.0 110.992 -178.815 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 43.5 ttt180 -62.29 -48.2 80.92 Favored 'General case' 0 CA--C 1.516 -0.363 0 C-N-CA 123.359 0.663 . . . . 0.0 110.499 -179.604 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -63.91 -46.11 86.27 Favored 'General case' 0 CA--C 1.518 -0.251 0 C-N-CA 120.659 -0.416 . . . . 0.0 110.09 -178.842 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 8.2 tptm -63.7 -44.63 93.07 Favored 'General case' 0 N--CA 1.455 -0.181 0 CA-C-O 119.615 -0.231 . . . . 0.0 110.993 -179.349 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -59.93 -51.64 68.82 Favored 'General case' 0 N--CA 1.454 -0.254 0 C-N-CA 124.041 0.936 . . . . 0.0 110.579 179.754 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 39.2 tt0 -64.65 -36.66 84.96 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-O 119.113 -0.47 . . . . 0.0 110.829 -179.053 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 27.5 t70 -67.69 -43.98 78.82 Favored 'General case' 0 CA--C 1.518 -0.267 0 C-N-CA 123.954 0.902 . . . . 0.0 109.802 179.147 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 31.2 t -73.23 -14.79 61.4 Favored 'General case' 0 CA--C 1.542 0.663 0 CA-C-O 122.105 0.955 . . . . 0.0 109.645 179.025 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 77.88 8.73 87.26 Favored Glycine 0 N--CA 1.443 -0.894 0 O-C-N 120.542 -1.349 . . . . 0.0 114.829 178.902 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 15.0 mt -114.41 118.36 33.62 Favored 'General case' 0 CA--C 1.515 -0.403 0 N-CA-C 103.742 -2.688 . . . . 0.0 103.742 179.252 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 12.7 t -48.13 158.75 0.23 Allowed 'General case' 0 C--N 1.329 -0.3 0 C-N-CA 124.811 1.244 . . . . 0.0 111.569 -179.292 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 69.7 t -46.06 -44.29 5.23 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.342 0 C-N-CA 125.038 1.335 . . . . 0.0 112.02 -178.885 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 11.8 p -62.72 -41.62 99.25 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-N 120.498 1.499 . . . . 0.0 111.848 -179.994 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -67.71 -49.98 59.87 Favored 'General case' 0 C--O 1.218 -0.569 0 N-CA-C 108.106 -1.072 . . . . 0.0 108.106 178.222 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 45.8 t80 -52.22 -51.38 58.59 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 123.963 0.905 . . . . 0.0 108.647 179.28 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.45 HG23 HG23 ' B' ' 45' ' ' ILE . 6.2 mm -55.61 -62.62 0.76 Allowed 'Isoleucine or valine' 0 C--O 1.225 -0.194 0 C-N-CA 125.704 1.602 . . . . 0.0 110.744 179.608 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 21.4 ptt180 -59.13 -45.7 90.24 Favored 'General case' 0 C--O 1.222 -0.343 0 CA-C-O 119.07 -0.491 . . . . 0.0 111.626 -178.162 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 21.7 t30 -58.25 -52.43 65.59 Favored 'General case' 0 N--CA 1.45 -0.464 0 C-N-CA 124.222 1.009 . . . . 0.0 111.099 -178.905 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -67.97 -25.62 65.53 Favored 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 124.333 1.053 . . . . 0.0 112.148 179.736 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -80.71 -41.97 22.72 Favored 'General case' 0 N--CA 1.454 -0.261 0 CA-C-N 118.428 0.558 . . . . 0.0 111.444 179.699 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 27.9 mt -73.2 -45.11 58.16 Favored 'General case' 0 CA--C 1.516 -0.355 0 C-N-CA 123.561 0.745 . . . . 0.0 111.809 -178.96 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 68.2 m-80 . . . . . 0 C--O 1.251 1.14 0 CA-C-O 116.961 -1.495 . . . . 0.0 111.136 -178.421 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 13.1 t . . . . . 0 N--CA 1.443 -0.822 0 CA-C-O 122.516 1.151 . . . . 0.0 111.428 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 2.6 t -143.73 91.22 0.41 Allowed 'Isoleucine or valine' 0 N--CA 1.441 -0.915 0 N-CA-C 103.757 -2.682 . . . . 0.0 103.757 178.378 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 8.1 p -92.27 118.6 38.15 Favored 'Isoleucine or valine' 0 C--O 1.239 0.528 0 N-CA-C 104.332 -2.47 . . . . 0.0 104.332 178.459 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 13.1 ttt85 -145.58 176.57 9.52 Favored 'General case' 0 C--O 1.233 0.229 0 O-C-N 121.432 -0.792 . . . . 0.0 109.732 -178.783 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 25.7 m -114.98 90.19 3.28 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 105.487 -2.042 . . . . 0.0 105.487 -179.546 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -95.06 106.12 18.09 Favored 'General case' 0 C--N 1.324 -0.533 0 C-N-CA 124.474 1.11 . . . . 0.0 108.176 -179.126 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 12.0 mtm180 -91.52 155.9 18.07 Favored 'General case' 0 C--O 1.238 0.467 0 CA-C-N 118.342 0.519 . . . . 0.0 111.357 178.892 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 22' ' ' PHE . . . . . . . . . . . . . 96.8 m-85 -136.44 143.97 44.17 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 107.801 -1.185 . . . . 0.0 107.801 179.796 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -75.21 168.17 30.07 Favored Pre-proline 0 CA--C 1.543 0.694 0 C-N-CA 123.555 0.742 . . . . 0.0 109.888 179.45 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 24' ' ' PRO . . . . . . . . . . . . . 34.2 Cg_endo -61.35 -40.83 45.91 Favored 'Trans proline' 0 C--N 1.348 0.541 0 C-N-CA 122.808 2.338 . . . . 0.0 113.283 -177.921 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 25' ' ' VAL . . . . . . . . . . . . . 38.5 t -72.15 -33.57 47.16 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.491 0 N-CA-C 109.271 -0.64 . . . . 0.0 109.271 179.562 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 68.6 mt-10 -65.94 -46.07 79.53 Favored 'General case' 0 C--N 1.343 0.316 0 N-CA-C 107.802 -1.184 . . . . 0.0 107.802 178.722 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 27' ' ' ASP . . . . . . . . . . . . . 4.0 t0 -58.9 -48.71 80.48 Favored 'General case' 0 CA--C 1.512 -0.494 0 C-N-CA 127.022 2.129 . . . . 0.0 110.075 179.216 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 28' ' ' GLU . . . . . . . . . . . . . 71.8 tt0 -56.38 -51.03 69.83 Favored 'General case' 0 N--CA 1.455 -0.204 0 CA-C-N 118.892 0.769 . . . . 0.0 109.874 179.53 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 60.8 m -60.94 -56.6 19.21 Favored 'General case' 0 N--CA 1.451 -0.422 0 C-N-CA 122.591 0.356 . . . . 0.0 110.934 -178.846 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 97.8 mt -57.26 -49.87 78.5 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.477 0 C-N-CA 123.001 0.52 . . . . 0.0 111.091 -178.57 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 53.2 ttt180 -59.84 -44.82 93.87 Favored 'General case' 0 CA--C 1.521 -0.171 0 CA-C-N 119.143 0.883 . . . . 0.0 111.284 -179.462 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.42 -45.48 87.39 Favored 'General case' 0 CA--C 1.51 -0.596 0 CA-C-O 118.765 -0.636 . . . . 0.0 110.693 -178.927 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 17.9 tptm -67.26 -46.96 72.13 Favored 'General case' 0 N--CA 1.453 -0.277 0 N-CA-C 109.61 -0.515 . . . . 0.0 109.61 -179.351 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 34' ' ' ALA . . . . . . . . . . . . . . . -56.86 -54.79 42.43 Favored 'General case' 0 N--CA 1.453 -0.292 0 C-N-CA 125.318 1.447 . . . . 0.0 112.693 -179.705 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 5.4 tt0 -70.2 -26.71 64.01 Favored 'General case' 0 C--O 1.233 0.235 0 N-CA-C 112.205 0.446 . . . . 0.0 112.205 -177.372 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 36' ' ' ASP . . . . . . . . . . . . . 15.0 t70 -75.04 -42.54 56.94 Favored 'General case' 0 C--N 1.331 -0.236 0 O-C-N 121.553 -0.717 . . . . 0.0 109.091 178.255 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 37' ' ' SER . . . . . . . . . . . . . 39.6 t -69.83 -23.81 63.36 Favored 'General case' 0 C--O 1.235 0.324 0 C-N-CA 126.017 1.727 . . . . 0.0 111.32 -179.812 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 81.09 23.18 59.65 Favored Glycine 0 CA--C 1.53 0.997 0 N-CA-C 110.355 -1.098 . . . . 0.0 110.355 -178.689 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 39' ' ' LEU . . . . . . . . . . . . . 57.8 mt -120.68 95.08 4.57 Favored 'General case' 0 N--CA 1.447 -0.62 1 N-CA-C 99.827 -4.138 . . . . 0.0 99.827 178.446 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 40' ' ' THR . . . . . . . . . . . . . 4.6 t -48.82 158.83 0.28 Allowed 'General case' 0 N--CA 1.457 -0.102 0 C-N-CA 122.783 0.433 . . . . 0.0 110.358 -178.952 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 41' ' ' VAL . . . . . . . . . . . . . 97.9 t -41.49 -47.9 0.83 Allowed 'Isoleucine or valine' 0 N--CA 1.447 -0.601 0 C-N-CA 124.221 1.008 . . . . 0.0 112.914 -176.828 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 42' ' ' SER . . . . . . . . . . . . . 2.5 p -65.43 -45.75 82.62 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 117.694 -1.603 . . . . 0.0 112.701 -179.403 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -61.02 -45.3 95.37 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 125.346 1.458 . . . . 0.0 110.389 179.225 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 44' ' ' TYR . . . . . . . . . . . . . 9.8 t80 -60.44 -46.29 90.57 Favored 'General case' 0 C--O 1.222 -0.342 0 C-N-CA 123.768 0.827 . . . . 0.0 109.861 179.456 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 45' ' ' ILE . . . . . 0.45 HG23 HG23 ' A' ' 45' ' ' ILE . 19.0 mm -57.67 -61.51 1.28 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.355 0 CA-C-N 119.656 1.116 . . . . 0.0 110.228 179.689 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 46' ' ' ARG . . . . . . . . . . . . . 21.7 ptt180 -53.65 -47.51 70.28 Favored 'General case' 0 CA--C 1.528 0.133 0 CA-C-O 119.373 -0.346 . . . . 0.0 111.641 -178.792 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 47' ' ' ASN . . . . . . . . . . . . . 41.9 t30 -64.33 -49.67 70.82 Favored 'General case' 0 C--O 1.234 0.286 0 N-CA-C 114.117 1.154 . . . . 0.0 114.117 -178.989 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -68.1 -21.31 64.97 Favored 'General case' 0 C--O 1.23 0.069 0 C-N-CA 124.19 0.996 . . . . 0.0 112.365 -179.344 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 49' ' ' ALA . . . . . . . . . . . . . . . -87.19 -40.3 14.7 Favored 'General case' 0 N--CA 1.451 -0.404 0 CA-C-N 118.587 0.63 . . . . 0.0 110.975 179.719 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 39.4 mt -68.29 -48.69 64.32 Favored 'General case' 0 C--O 1.233 0.208 0 O-C-N 121.612 -0.68 . . . . 0.0 112.834 -179.055 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 51' ' ' ASN . . . . . . . . . . . . . 44.2 m-80 . . . . . 0 C--O 1.247 0.922 0 CA-C-O 117.445 -1.264 . . . . 0.0 112.565 -177.026 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 3.2 t . . . . . 0 N--CA 1.445 -0.687 0 N-CA-C 107.12 -1.437 . . . . 0.0 107.12 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . 0.401 HG21 ' CG ' ' B' ' 27' ' ' ASP . 3.7 t -131.62 144.3 37.86 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 N-CA-C 106.038 -1.838 . . . . 0.0 106.038 178.435 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 9.4 p -135.61 103.53 4.01 Favored 'Isoleucine or valine' 0 C--O 1.238 0.487 0 N-CA-C 105.931 -1.877 . . . . 0.0 105.931 179.49 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 30.9 ttm180 -139.27 151.09 46.19 Favored 'General case' 0 CA--C 1.514 -0.438 0 CA-C-N 115.005 -0.998 . . . . 0.0 109.516 -179.706 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 19.4 m -103.05 144.6 31.08 Favored 'General case' 0 N--CA 1.449 -0.507 0 N-CA-C 107.344 -1.354 . . . . 0.0 107.344 -179.845 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 54.4 mt -133.32 142.33 48.4 Favored 'General case' 0 C--O 1.236 0.353 0 CA-C-O 121.902 0.858 . . . . 0.0 109.334 179.44 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 10.8 mmt85 -102.18 141.59 34.78 Favored 'General case' 0 N--CA 1.451 -0.389 0 C-N-CA 126.707 2.003 . . . . 0.0 106.809 178.898 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 95.0 m-85 -140.6 143.58 35.33 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 105.418 -2.067 . . . . 0.0 105.418 179.342 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 1.7 m -78.72 165.28 50.61 Favored Pre-proline 0 CA--C 1.539 0.526 0 N-CA-C 108.298 -1.001 . . . . 0.0 108.298 179.851 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -67.5 -21.14 46.86 Favored 'Trans proline' 0 CA--C 1.535 0.539 0 C-N-CA 122.018 1.812 . . . . 0.0 112.107 -179.642 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 16.0 t -82.89 -20.87 9.35 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.409 0 C-N-CA 125.07 1.348 . . . . 0.0 110.687 -179.686 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 93.6 mt-10 -92.61 -46.64 7.5 Favored 'General case' 0 CA--C 1.531 0.23 0 N-CA-C 107.047 -1.464 . . . . 0.0 107.047 178.782 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 2.9 t70 -55.69 -52.7 62.97 Favored 'General case' 0 CA--C 1.507 -0.693 0 C-N-CA 128.601 2.76 . . . . 0.0 112.817 179.792 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -60.99 -38.66 86.79 Favored 'General case' 0 N--CA 1.45 -0.447 0 C-N-CA 119.451 -0.9 . . . . 0.0 110.209 -178.508 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 89.5 m -64.96 -53.01 53.0 Favored 'General case' 0 N--CA 1.451 -0.376 0 CA-C-O 118.83 -0.605 . . . . 0.0 109.628 179.015 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 78.2 mt -56.57 -43.7 79.14 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.203 0 N-CA-C 109.06 -0.718 . . . . 0.0 109.06 -179.708 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 55.2 ttt180 -61.82 -50.6 71.66 Favored 'General case' 0 N--CA 1.455 -0.2 0 C-N-CA 123.734 0.814 . . . . 0.0 110.792 179.402 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 2.4 mptm? -61.86 -46.81 87.84 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-N 118.747 0.703 . . . . 0.0 110.257 -179.101 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 26.0 mmtp -63.74 -45.01 91.83 Favored 'General case' 0 C--O 1.227 -0.124 0 CA-C-N 118.655 0.661 . . . . 0.0 110.322 -179.799 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -60.57 -46.55 89.79 Favored 'General case' 0 C--O 1.237 0.413 0 C-N-CA 123.733 0.813 . . . . 0.0 110.424 179.753 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 27.7 tt0 -67.14 -39.65 86.62 Favored 'General case' 0 N--CA 1.454 -0.263 0 O-C-N 121.849 -0.532 . . . . 0.0 110.815 -179.564 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -67.58 -44.27 78.55 Favored 'General case' 0 N--CA 1.456 -0.168 0 O-C-N 121.747 -0.596 . . . . 0.0 110.347 -179.999 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 6.8 t -69.53 -17.29 63.57 Favored 'General case' 0 N--CA 1.449 -0.516 0 C-N-CA 124.553 1.141 . . . . 0.0 111.764 -178.602 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 75.43 26.42 65.76 Favored Glycine 0 CA--C 1.53 1.001 0 CA-C-N 118.853 0.751 . . . . 0.0 111.353 -179.969 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 88.6 mt -127.78 114.21 16.96 Favored 'General case' 0 N--CA 1.454 -0.233 0 C-N-CA 127.46 2.304 . . . . 0.0 105.517 179.902 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 9.4 t -52.22 154.9 2.16 Favored 'General case' 0 CA--C 1.536 0.421 0 CA-C-N 119.397 0.998 . . . . 0.0 109.664 179.747 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 53.6 t -46.78 -41.95 5.54 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.311 0 C-N-CA 125.407 1.483 . . . . 0.0 112.011 -179.052 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 7.1 p -63.86 -48.84 75.12 Favored 'General case' 0 CA--C 1.541 0.599 0 CA-C-N 119.599 1.09 . . . . 0.0 110.822 179.557 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -62.2 -45.56 92.84 Favored 'General case' 0 C--O 1.223 -0.293 0 C-N-CA 124.837 1.255 . . . . 0.0 109.509 178.621 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 71.6 t80 -54.92 -50.38 68.96 Favored 'General case' 0 N--CA 1.452 -0.351 0 C-N-CA 125.056 1.343 . . . . 0.0 108.802 179.308 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 8.3 mm -56.44 -63.59 0.6 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.316 0 C-N-CA 124.229 1.012 . . . . 0.0 110.505 179.406 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 25.8 ptt180 -55.53 -41.47 73.2 Favored 'General case' 0 N--CA 1.466 0.333 0 O-C-N 121.607 -0.683 . . . . 0.0 111.807 -178.657 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 22.2 t30 -60.81 -53.47 56.93 Favored 'General case' 0 N--CA 1.453 -0.321 0 C-N-CA 123.81 0.844 . . . . 0.0 110.944 179.803 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -63.82 -32.02 73.39 Favored 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 123.532 0.733 . . . . 0.0 112.375 -179.58 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -73.06 -28.73 62.48 Favored 'General case' 0 CA--C 1.531 0.222 0 N-CA-C 113.366 0.876 . . . . 0.0 113.366 -179.317 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 19.2 mt -92.23 -34.74 14.15 Favored 'General case' 0 C--O 1.236 0.381 0 O-C-N 121.912 -0.493 . . . . 0.0 110.758 -179.592 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 28.8 m-80 . . . . . 0 C--O 1.249 1.044 0 C-N-CA 124.438 1.095 . . . . 0.0 108.848 179.896 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 1.9 t . . . . . 0 N--CA 1.444 -0.747 0 N-CA-C 107.717 -1.216 . . . . 0.0 107.717 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 38.9 t -108.38 153.89 9.81 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.687 0 N-CA-C 105.884 -1.895 . . . . 0.0 105.884 178.332 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 9.8 p -150.24 103.48 0.33 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.555 0 N-CA-C 107.826 -1.176 . . . . 0.0 107.826 178.885 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 15.7 ttm180 -146.55 152.75 39.46 Favored 'General case' 0 C--N 1.328 -0.344 0 O-C-N 121.355 -0.84 . . . . 0.0 109.783 -179.932 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 7.1 m -96.72 140.08 31.83 Favored 'General case' 0 N--CA 1.448 -0.529 0 C-N-CA 125.446 1.498 . . . . 0.0 108.169 179.322 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 95.0 mt -123.06 165.73 16.31 Favored 'General case' 0 C--O 1.236 0.38 0 N-CA-C 106.965 -1.494 . . . . 0.0 106.965 178.213 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 1.9 mmt85 -125.22 143.92 50.71 Favored 'General case' 0 C--O 1.239 0.525 0 C-N-CA 126.565 1.946 . . . . 0.0 108.34 179.531 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 22' ' ' PHE . . . . . . . . . . . . . 97.4 m-85 -141.41 141.9 33.74 Favored 'General case' 0 CA--C 1.516 -0.347 0 N-CA-C 105.407 -2.071 . . . . 0.0 105.407 179.75 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 4.9 m -79.75 165.0 50.47 Favored Pre-proline 0 C--N 1.324 -0.531 0 CA-C-O 118.432 -0.794 . . . . 0.0 109.171 -179.482 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 24' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -67.27 -5.32 13.55 Favored 'Trans proline' 0 CA--C 1.537 0.645 0 C-N-CA 122.9 2.4 . . . . 0.0 113.165 179.811 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 25' ' ' VAL . . . . . . . . . . . . . 55.4 t -93.85 -61.75 1.99 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.487 0 N-CA-C 104.934 -2.247 . . . . 0.0 104.934 178.713 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 63.6 mt-10 -53.84 -48.12 70.28 Favored 'General case' 0 N--CA 1.455 -0.217 0 C-N-CA 126.186 1.795 . . . . 0.0 110.961 -179.528 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 27' ' ' ASP . . . . . 0.401 ' CG ' HG21 ' A' ' 16' ' ' VAL . 15.5 t70 -61.25 -50.68 72.08 Favored 'General case' 0 CA--C 1.511 -0.526 0 C-N-CA 124.81 1.244 . . . . 0.0 112.048 -179.841 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 28' ' ' GLU . . . . . . . . . . . . . 5.4 tp10 -60.26 -43.57 96.04 Favored 'General case' 0 N--CA 1.449 -0.478 0 N-CA-C 108.645 -0.872 . . . . 0.0 108.645 -179.318 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 53.4 m -59.37 -54.36 47.59 Favored 'General case' 0 N--CA 1.452 -0.339 0 N-CA-C 108.731 -0.84 . . . . 0.0 108.731 178.902 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 71.3 mt -58.53 -43.96 88.15 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.317 0 C-N-CA 123.194 0.597 . . . . 0.0 110.191 -179.524 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 31.5 ttt180 -56.3 -49.44 74.29 Favored 'General case' 0 C--N 1.333 -0.147 0 C-N-CA 123.929 0.891 . . . . 0.0 109.624 179.711 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 1.4 mptm? -67.4 -43.07 82.21 Favored 'General case' 0 C--O 1.223 -0.309 0 CA-C-O 117.758 -1.115 . . . . 0.0 110.757 -179.572 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 29.3 mmtp -63.11 -44.14 96.49 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-N 119.842 1.201 . . . . 0.0 110.665 -179.559 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 34' ' ' ALA . . . . . . . . . . . . . . . -59.32 -56.6 20.02 Favored 'General case' 0 N--CA 1.451 -0.423 0 C-N-CA 124.8 1.24 . . . . 0.0 109.158 179.63 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -61.77 -37.94 86.18 Favored 'General case' 0 C--O 1.236 0.364 0 C-N-CA 123.389 0.676 . . . . 0.0 112.024 -178.688 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 36' ' ' ASP . . . . . . . . . . . . . 9.3 t70 -64.54 -40.7 96.08 Favored 'General case' 0 C--N 1.332 -0.153 0 C-N-CA 125.337 1.455 . . . . 0.0 108.655 178.785 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 37' ' ' SER . . . . . . . . . . . . . 6.2 t -77.78 -8.36 57.9 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 123.738 0.815 . . . . 0.0 110.453 179.013 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 69.45 24.17 76.22 Favored Glycine 0 CA--C 1.531 1.041 0 O-C-N 121.053 -1.029 . . . . 0.0 110.733 -178.991 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 39' ' ' LEU . . . . . . . . . . . . . 71.7 mt -115.99 128.07 55.44 Favored 'General case' 0 N--CA 1.447 -0.595 0 C-N-CA 126.313 1.845 . . . . 0.0 107.399 -179.239 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 40' ' ' THR . . . . . . . . . . . . . 3.5 t -57.31 145.28 32.69 Favored 'General case' 0 CA--C 1.538 0.51 0 N-CA-C 106.717 -1.586 . . . . 0.0 106.717 177.747 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 41' ' ' VAL . . . . . . . . . . . . . 94.1 t -49.8 -41.09 16.63 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.28 0 O-C-N 120.772 -1.205 . . . . 0.0 112.106 -178.735 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 42' ' ' SER . . . . . . . . . . . . . 11.3 m -61.64 -40.75 96.0 Favored 'General case' 0 CA--C 1.541 0.61 0 CA-C-N 119.768 1.167 . . . . 0.0 111.373 -179.648 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -68.59 -44.09 75.08 Favored 'General case' 0 C--O 1.22 -0.477 0 C-N-CA 124.389 1.076 . . . . 0.0 108.097 178.13 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 44' ' ' TYR . . . . . . . . . . . . . 70.6 t80 -55.22 -51.99 64.81 Favored 'General case' 0 N--CA 1.454 -0.254 0 N-CA-C 108.726 -0.842 . . . . 0.0 108.726 179.393 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 45' ' ' ILE . . . . . . . . . . . . . 19.3 mm -53.24 -64.65 0.38 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.23 0 C-N-CA 124.328 1.051 . . . . 0.0 111.47 179.545 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 46' ' ' ARG . . . . . . . . . . . . . 27.1 ptt180 -58.11 -42.06 84.92 Favored 'General case' 0 C--O 1.223 -0.331 0 CA-C-O 118.745 -0.645 . . . . 0.0 111.716 -177.978 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 47' ' ' ASN . . . . . . . . . . . . . 43.8 t30 -60.92 -54.84 40.16 Favored 'General case' 0 N--CA 1.45 -0.474 0 CA-C-O 118.655 -0.688 . . . . 0.0 110.216 -179.72 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -58.78 -31.31 68.27 Favored 'General case' 0 CA--C 1.53 0.201 0 C-N-CA 124.03 0.932 . . . . 0.0 111.56 -179.783 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 49' ' ' ALA . . . . . . . . . . . . . . . -74.86 -20.89 59.55 Favored 'General case' 0 N--CA 1.454 -0.273 0 N-CA-C 113.267 0.84 . . . . 0.0 113.267 -179.708 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 11.8 mt -107.91 -29.02 9.27 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 119.417 1.008 . . . . 0.0 111.592 -179.41 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 51' ' ' ASN . . . . . . . . . . . . . 73.0 m-20 . . . . . 0 C--O 1.245 0.855 0 C-N-CA 126.41 1.884 . . . . 0.0 109.817 -178.99 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 4.3 t . . . . . 0 N--CA 1.445 -0.691 0 CA-C-O 121.466 0.65 . . . . 0.0 109.409 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . 0.424 HG21 ' HB2' ' B' ' 27' ' ' ASP . 1.4 t -125.62 102.76 10.8 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.457 0 C-N-CA 123.562 0.745 . . . . 0.0 110.187 -177.9 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 3.1 p -101.25 127.51 54.45 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.412 0 C-N-CA 124.133 0.973 . . . . 0.0 110.872 -178.035 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 14.8 ttm180 -154.66 160.92 41.71 Favored 'General case' 0 C--O 1.237 0.399 0 N-CA-C 108.771 -0.826 . . . . 0.0 108.771 178.045 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 7.1 m -90.76 91.61 8.45 Favored 'General case' 0 C--O 1.237 0.401 0 N-CA-C 107.473 -1.306 . . . . 0.0 107.473 179.565 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -97.84 100.78 12.15 Favored 'General case' 0 C--O 1.236 0.393 0 N-CA-C 107.568 -1.271 . . . . 0.0 107.568 179.147 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 32.9 mtt180 -87.57 159.03 18.75 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 108.992 -0.744 . . . . 0.0 108.992 179.585 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 86.0 m-85 -136.58 152.02 50.01 Favored 'General case' 0 CA--C 1.511 -0.535 0 N-CA-C 108.151 -1.055 . . . . 0.0 108.151 -179.765 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -82.88 171.83 10.84 Favored Pre-proline 0 CA--C 1.539 0.525 0 N-CA-C 107.48 -1.304 . . . . 0.0 107.48 179.664 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -67.24 -37.26 18.68 Favored 'Trans proline' 0 N--CA 1.457 -0.66 0 C-N-CA 121.483 1.455 . . . . 0.0 112.712 -178.473 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 92.3 t -66.58 -53.06 39.2 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.324 0 N-CA-C 107.825 -1.176 . . . . 0.0 107.825 179.508 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 -57.84 -47.24 83.25 Favored 'General case' 0 N--CA 1.455 -0.182 0 C-N-CA 122.941 0.496 . . . . 0.0 110.443 179.576 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 21.7 t70 -59.54 -52.27 66.29 Favored 'General case' 0 CA--C 1.507 -0.676 0 C-N-CA 123.147 0.579 . . . . 0.0 111.257 -179.979 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -56.1 -38.54 70.89 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 118.351 0.523 . . . . 0.0 110.594 -179.456 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 25.9 m -67.05 -56.48 9.9 Favored 'General case' 0 N--CA 1.449 -0.495 0 C-N-CA 123.359 0.664 . . . . 0.0 109.874 179.527 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 88.2 mt -60.16 -38.89 78.85 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.252 0 C-N-CA 123.834 0.854 . . . . 0.0 109.758 -179.394 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 64.4 ttt180 -61.86 -51.72 67.05 Favored 'General case' 0 C--O 1.223 -0.293 0 C-N-CA 124.857 1.263 . . . . 0.0 108.341 179.217 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 2.6 mptp? -59.42 -48.97 79.61 Favored 'General case' 0 CA--C 1.515 -0.381 0 C-N-CA 123.305 0.642 . . . . 0.0 109.529 179.78 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 64.4 mmtt -60.88 -45.72 93.47 Favored 'General case' 0 CA--C 1.509 -0.626 0 CA-C-O 118.565 -0.731 . . . . 0.0 111.871 -178.943 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -63.41 -53.71 48.12 Favored 'General case' 0 N--CA 1.446 -0.665 0 O-C-N 123.595 0.559 . . . . 0.0 110.161 -179.256 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -61.13 -36.88 80.91 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 123.378 0.671 . . . . 0.0 111.824 -177.866 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -73.41 -33.77 65.13 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 125.331 1.452 . . . . 0.0 109.696 178.752 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 30.0 t -72.71 -13.69 61.4 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 125.079 1.352 . . . . 0.0 108.09 177.55 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 82.95 -9.88 59.06 Favored Glycine 0 C--N 1.338 0.694 0 C-N-CA 125.639 1.59 . . . . 0.0 111.784 -179.01 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 82.6 mt -86.3 173.25 9.86 Favored 'General case' 0 N--CA 1.439 -0.98 0 C-N-CA 126.0 1.72 . . . . 0.0 107.222 179.745 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -96.51 157.09 16.06 Favored 'General case' 0 C--N 1.317 -0.844 0 N-CA-C 104.548 -2.389 . . . . 0.0 104.548 177.362 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 84.3 t -51.01 -40.9 21.51 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.382 0 C-N-CA 123.635 0.774 . . . . 0.0 109.503 178.731 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 10.5 p -60.99 -45.05 96.35 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-N 120.428 1.467 . . . . 0.0 112.012 -179.652 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -66.68 -48.39 69.47 Favored 'General case' 0 C--O 1.225 -0.185 0 C-N-CA 123.973 0.909 . . . . 0.0 109.523 179.104 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 87.9 t80 -56.52 -47.13 80.01 Favored 'General case' 0 CA--C 1.538 0.503 0 N-CA-C 109.584 -0.524 . . . . 0.0 109.584 179.819 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 5.9 mm -54.58 -64.45 0.44 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.357 0 C-N-CA 124.896 1.278 . . . . 0.0 110.592 179.477 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 13.1 ptm180 -56.08 -45.06 79.49 Favored 'General case' 0 C--O 1.219 -0.5 0 CA-C-O 118.97 -0.538 . . . . 0.0 110.889 -178.744 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 43.0 t30 -59.28 -54.91 41.45 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-N 118.405 0.548 . . . . 0.0 111.901 -179.299 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -61.81 -29.93 70.48 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 123.813 0.845 . . . . 0.0 111.596 -179.603 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -75.0 -23.06 58.18 Favored 'General case' 0 C--O 1.223 -0.291 0 N-CA-C 113.615 0.969 . . . . 0.0 113.615 179.84 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 6.9 mt -99.93 -39.1 8.33 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 119.62 1.1 . . . . 0.0 112.174 -178.643 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 22.0 m-80 . . . . . 0 C--O 1.254 1.325 0 CA-C-O 116.329 -1.796 . . . . 0.0 113.187 -178.817 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 4.6 t . . . . . 0 N--CA 1.449 -0.505 0 N-CA-C 108.202 -1.036 . . . . 0.0 108.202 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 24.7 t -116.28 148.18 19.17 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.504 0 N-CA-C 106.524 -1.658 . . . . 0.0 106.524 179.146 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 10.7 p -141.25 106.26 1.7 Allowed 'Isoleucine or valine' 0 N--CA 1.447 -0.614 0 N-CA-C 107.299 -1.371 . . . . 0.0 107.299 177.644 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 33.0 ttm180 -136.51 159.74 40.88 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.32 -0.855 . . . . 0.0 109.228 179.911 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 11.6 m -97.38 87.62 4.19 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 107.42 -1.326 . . . . 0.0 107.42 -179.78 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -81.82 105.49 12.99 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 108.812 -0.81 . . . . 0.0 108.812 -179.806 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 10.1 mtm180 -93.7 142.28 27.54 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 126.56 1.944 . . . . 0.0 110.918 -179.885 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 22' ' ' PHE . . . . . . . . . . . . . 78.0 m-85 -129.56 170.52 13.65 Favored 'General case' 0 N--CA 1.482 1.128 0 C-N-CA 125.192 1.397 . . . . 0.0 111.365 -179.15 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 2.0 m -99.09 166.03 13.78 Favored Pre-proline 0 CA--C 1.538 0.483 0 N-CA-C 108.04 -1.096 . . . . 0.0 108.04 178.809 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 24' ' ' PRO . . . . . . . . . . . . . 70.6 Cg_endo -69.16 -28.43 28.15 Favored 'Trans proline' 0 N--CA 1.458 -0.561 0 C-N-CA 121.442 1.428 . . . . 0.0 112.398 -179.72 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 25' ' ' VAL . . . . . . . . . . . . . 96.1 t -67.51 -56.75 12.12 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.31 0 N-CA-C 106.751 -1.574 . . . . 0.0 106.751 179.249 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 1.4 mp0 -56.44 -44.05 80.09 Favored 'General case' 0 CA--C 1.528 0.114 0 C-N-CA 124.92 1.288 . . . . 0.0 111.432 179.53 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 27' ' ' ASP . . . . . 0.424 ' HB2' HG21 ' A' ' 16' ' ' VAL . 30.1 t70 -62.78 -37.53 87.05 Favored 'General case' 0 CA--C 1.517 -0.3 0 N-CA-C 113.131 0.789 . . . . 0.0 113.131 -179.628 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 28' ' ' GLU . . . . . . . . . . . . . 32.3 tt0 -61.62 -50.82 71.0 Favored 'General case' 0 N--CA 1.45 -0.439 0 N-CA-C 107.141 -1.429 . . . . 0.0 107.141 178.963 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 30.3 m -58.83 -59.22 5.78 Favored 'General case' 0 N--CA 1.451 -0.395 0 C-N-CA 124.489 1.116 . . . . 0.0 111.279 -179.473 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 74.9 mt -56.67 -46.12 82.83 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.22 0 C-N-CA 124.45 1.1 . . . . 0.0 110.24 -178.78 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 56.4 ttt180 -62.22 -45.45 93.3 Favored 'General case' 0 CA--C 1.518 -0.279 0 CA-C-N 119.288 0.949 . . . . 0.0 111.255 -179.499 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 4.9 mptp? -60.05 -51.37 69.91 Favored 'General case' 0 CA--C 1.515 -0.397 0 N-CA-C 109.802 -0.444 . . . . 0.0 109.802 -179.059 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 37.2 mmtt -60.27 -52.99 62.92 Favored 'General case' 0 N--CA 1.449 -0.512 0 O-C-N 124.431 1.082 . . . . 0.0 111.022 -179.035 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 34' ' ' ALA . . . . . . . . . . . . . . . -55.94 -54.05 49.42 Favored 'General case' 0 N--CA 1.45 -0.467 0 C-N-CA 123.674 0.79 . . . . 0.0 111.318 -178.818 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 24.6 tt0 -63.16 -42.77 99.47 Favored 'General case' 0 N--CA 1.451 -0.406 0 N-CA-C 112.588 0.588 . . . . 0.0 112.588 -178.094 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 36' ' ' ASP . . . . . . . . . . . . . 26.9 t70 -65.64 -36.9 85.02 Favored 'General case' 0 C--O 1.232 0.143 0 C-N-CA 123.586 0.754 . . . . 0.0 110.502 -179.888 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 37' ' ' SER . . . . . . . . . . . . . 12.4 t -78.83 -7.25 57.7 Favored 'General case' 0 N--CA 1.446 -0.629 0 C-N-CA 123.995 0.918 . . . . 0.0 110.819 179.261 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 70.62 10.34 66.92 Favored Glycine 0 CA--C 1.536 1.346 0 CA-C-N 119.732 1.151 . . . . 0.0 113.28 -179.616 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 39' ' ' LEU . . . . . . . . . . . . . 15.2 mt -108.92 107.56 17.99 Favored 'General case' 0 N--CA 1.451 -0.382 0 N-CA-C 103.961 -2.607 . . . . 0.0 103.961 179.475 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 40' ' ' THR . . . . . . . . . . . . . 13.5 t -46.74 151.66 0.57 Allowed 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 123.808 0.843 . . . . 0.0 109.969 179.582 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 41' ' ' VAL . . . . . . . . . . . . . 58.8 t -43.62 -43.14 1.64 Allowed 'Isoleucine or valine' 0 CA--C 1.527 0.07 0 C-N-CA 125.441 1.496 . . . . 0.0 111.902 -178.109 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 42' ' ' SER . . . . . . . . . . . . . 5.4 p -66.55 -43.64 84.52 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-N 119.588 1.085 . . . . 0.0 112.747 179.458 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.72 -40.76 97.55 Favored 'General case' 0 C--O 1.232 0.137 0 N-CA-C 109.175 -0.676 . . . . 0.0 109.175 178.583 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 44' ' ' TYR . . . . . . . . . . . . . 64.3 t80 -60.6 -53.31 59.04 Favored 'General case' 0 N--CA 1.442 -0.841 0 N-CA-C 107.975 -1.12 . . . . 0.0 107.975 179.146 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 45' ' ' ILE . . . . . . . . . . . . . 19.7 mm -55.04 -54.46 23.85 Favored 'Isoleucine or valine' 0 C--N 1.341 0.231 0 C-N-CA 123.387 0.675 . . . . 0.0 109.285 179.521 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 46' ' ' ARG . . . . . . . . . . . . . 1.1 mtp180 -47.29 -64.59 0.74 Allowed 'General case' 0 C--O 1.22 -0.465 0 C-N-CA 124.138 0.975 . . . . 0.0 109.902 179.43 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 47' ' ' ASN . . . . . . . . . . . . . 27.4 t30 -54.19 -51.15 65.3 Favored 'General case' 0 C--N 1.325 -0.499 0 C-N-CA 126.583 1.953 . . . . 0.0 113.763 -177.944 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -60.39 -29.28 68.84 Favored 'General case' 0 N--CA 1.453 -0.324 0 C-N-CA 122.997 0.519 . . . . 0.0 112.362 -179.062 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 49' ' ' ALA . . . . . . . . . . . . . . . -86.41 -12.42 49.21 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 113.675 0.991 . . . . 0.0 113.675 -179.306 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 11.2 mt -104.86 -29.09 10.73 Favored 'General case' 0 CA--C 1.516 -0.353 0 O-C-N 121.213 -0.929 . . . . 0.0 111.154 -178.932 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 51' ' ' ASN . . . . . . . . . . . . . 74.4 m-80 . . . . . 0 C--O 1.249 1.04 0 C-N-CA 125.337 1.455 . . . . 0.0 111.298 -179.057 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 3.1 t . . . . . 0 N--CA 1.451 -0.391 0 N-CA-C 107.691 -1.226 . . . . 0.0 107.691 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 2.5 t -107.29 145.87 14.18 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.764 0 N-CA-C 106.552 -1.648 . . . . 0.0 106.552 179.142 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 14.5 p -140.69 110.26 3.24 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.765 0 N-CA-C 105.209 -2.145 . . . . 0.0 105.209 178.298 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 21.6 ttt85 -144.72 -175.86 4.83 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 109.348 -0.612 . . . . 0.0 109.348 -178.945 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 13.4 m -119.35 112.43 19.42 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-N 118.82 0.737 . . . . 0.0 110.519 -179.107 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.451 HD21 ' HA ' ' B' ' 42' ' ' SER . 0.0 OUTLIER -105.56 100.74 10.3 Favored 'General case' 0 C--O 1.236 0.344 0 C-N-CA 125.788 1.635 . . . . 0.0 107.64 179.788 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 6.1 mtt180 -84.97 157.46 20.79 Favored 'General case' 0 C--O 1.234 0.239 0 N-CA-C 108.437 -0.949 . . . . 0.0 108.437 177.937 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 92.7 m-85 -140.24 152.54 46.03 Favored 'General case' 0 C--O 1.236 0.359 0 N-CA-C 107.38 -1.341 . . . . 0.0 107.38 179.629 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 1.5 m -83.06 171.59 11.34 Favored Pre-proline 0 CA--C 1.547 0.832 0 CA-C-O 117.772 -1.109 . . . . 0.0 108.233 179.602 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_endo -63.75 -48.44 5.48 Favored 'Trans proline' 0 C--N 1.347 0.497 0 C-N-CA 122.025 1.817 . . . . 0.0 114.713 -177.417 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 93.9 t -64.63 -37.96 81.42 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.337 0 C-N-CA 124.787 1.235 . . . . 0.0 110.375 -179.603 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -64.33 -53.48 48.14 Favored 'General case' 0 N--CA 1.454 -0.264 0 C-N-CA 125.526 1.53 . . . . 0.0 108.043 -179.576 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 3.5 t70 -60.24 -42.91 96.27 Favored 'General case' 0 C--N 1.331 -0.204 0 C-N-CA 127.479 2.312 . . . . 0.0 111.425 179.583 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 88.7 tt0 -63.88 -49.39 72.89 Favored 'General case' 0 N--CA 1.45 -0.434 0 N-CA-C 108.018 -1.105 . . . . 0.0 108.018 179.135 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 91.2 m -58.54 -49.78 76.17 Favored 'General case' 0 CA--C 1.533 0.325 0 N-CA-C 109.169 -0.678 . . . . 0.0 109.169 179.274 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . 0.403 HD13 HD11 ' A' ' 45' ' ' ILE . 34.0 mt -58.07 -46.34 88.15 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.303 0 C-N-CA 123.307 0.643 . . . . 0.0 109.38 179.54 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 29.1 ttt180 -60.36 -51.19 70.55 Favored 'General case' 0 CA--C 1.518 -0.284 0 CA-C-N 118.784 0.72 . . . . 0.0 110.839 -179.626 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 1.7 mptm? -61.85 -44.9 95.9 Favored 'General case' 0 CA--C 1.52 -0.21 0 CA-C-O 118.547 -0.74 . . . . 0.0 109.691 -179.092 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 38.4 tptt -64.57 -38.97 92.83 Favored 'General case' 0 C--O 1.224 -0.255 0 CA-C-N 118.905 0.775 . . . . 0.0 110.694 -179.614 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -63.46 -54.67 32.82 Favored 'General case' 0 C--O 1.234 0.263 0 C-N-CA 125.258 1.423 . . . . 0.0 108.578 178.839 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 7.4 tp10 -59.16 -40.05 84.4 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 124.324 1.049 . . . . 0.0 110.48 -179.364 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -71.38 -37.24 71.59 Favored 'General case' 0 CA--C 1.53 0.199 0 C-N-CA 125.751 1.62 . . . . 0.0 111.713 179.704 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 22.7 t -76.67 -15.63 59.75 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 124.441 1.096 . . . . 0.0 111.393 179.784 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 77.54 34.43 39.91 Favored Glycine 0 CA--C 1.53 0.97 0 N-CA-C 110.017 -1.233 . . . . 0.0 110.017 -179.121 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 90.8 mt -136.49 132.69 35.66 Favored 'General case' 0 CA--C 1.514 -0.424 0 N-CA-C 106.735 -1.58 . . . . 0.0 106.735 179.792 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 6.7 t -62.68 150.91 39.77 Favored 'General case' 0 CA--C 1.537 0.471 0 N-CA-C 107.544 -1.28 . . . . 0.0 107.544 178.616 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 41.7 t -47.09 -45.13 8.3 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.446 0 C-N-CA 125.025 1.33 . . . . 0.0 111.513 -179.752 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 56.7 p -56.73 -45.5 81.9 Favored 'General case' 0 CA--C 1.535 0.39 0 CA-C-N 119.029 0.831 . . . . 0.0 111.922 -179.625 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -71.72 -44.33 64.34 Favored 'General case' 0 N--CA 1.449 -0.48 0 C-N-CA 124.369 1.068 . . . . 0.0 109.5 179.104 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 93.2 t80 -52.1 -48.75 64.6 Favored 'General case' 0 CA--C 1.53 0.182 0 C-N-CA 124.519 1.128 . . . . 0.0 109.196 179.79 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.508 HG23 HG23 ' B' ' 45' ' ' ILE . 24.2 mm -55.74 -66.61 0.27 Allowed 'Isoleucine or valine' 0 C--O 1.226 -0.143 0 C-N-CA 123.918 0.887 . . . . 0.0 111.411 179.626 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 15.7 ptt180 -58.54 -45.39 89.0 Favored 'General case' 0 C--O 1.219 -0.516 0 CA-C-O 118.398 -0.81 . . . . 0.0 112.001 -177.811 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 16.6 t30 -55.34 -47.72 75.27 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 119.153 0.888 . . . . 0.0 111.451 -179.41 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -67.51 -30.9 70.69 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 122.823 0.449 . . . . 0.0 111.896 179.452 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -77.58 -29.01 51.87 Favored 'General case' 0 N--CA 1.451 -0.418 0 C-N-CA 124.245 1.018 . . . . 0.0 113.432 -179.65 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 8.9 mt -89.23 -39.52 13.47 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 113.279 0.844 . . . . 0.0 113.279 -178.33 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 65.7 m-20 . . . . . 0 C--O 1.251 1.181 0 C-N-CA 123.566 0.746 . . . . 0.0 112.657 -178.446 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 4.3 t . . . . . 0 N--CA 1.449 -0.5 0 N-CA-C 108.059 -1.089 . . . . 0.0 108.059 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 5.8 t -107.18 157.07 7.45 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 N-CA-C 106.34 -1.726 . . . . 0.0 106.34 178.405 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 10.9 p -151.21 120.4 0.87 Allowed 'Isoleucine or valine' 0 N--CA 1.444 -0.76 0 N-CA-C 105.017 -2.216 . . . . 0.0 105.017 178.585 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 4.9 ttt85 -145.96 175.67 10.27 Favored 'General case' 0 C--O 1.238 0.457 0 C-N-CA 119.646 -0.822 . . . . 0.0 111.702 -179.845 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 20.9 m -115.27 76.67 1.01 Allowed 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 106.708 -1.59 . . . . 0.0 106.708 -179.631 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 52.6 tp -89.52 93.16 9.39 Favored 'General case' 0 N--CA 1.448 -0.558 0 C-N-CA 127.362 2.265 . . . . 0.0 107.935 -179.212 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 41.2 mtt180 -76.89 164.56 25.69 Favored 'General case' 0 C--N 1.326 -0.44 0 C-N-CA 123.715 0.806 . . . . 0.0 110.963 -179.728 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 22' ' ' PHE . . . . . . . . . . . . . 69.3 m-85 -142.47 148.56 37.91 Favored 'General case' 0 C--O 1.237 0.395 0 N-CA-C 107.57 -1.27 . . . . 0.0 107.57 179.849 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 49.3 m -79.62 166.12 43.25 Favored Pre-proline 0 CA--C 1.541 0.612 0 N-CA-C 107.771 -1.196 . . . . 0.0 107.771 179.33 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 24' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -64.73 -35.43 46.21 Favored 'Trans proline' 0 C--N 1.348 0.517 0 C-N-CA 121.517 1.478 . . . . 0.0 112.118 -178.696 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 25' ' ' VAL . . . . . . . . . . . . . 89.4 t -60.62 -55.25 25.71 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.375 0 N-CA-C 108.219 -1.03 . . . . 0.0 108.219 179.392 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 4.2 mm-40 -59.92 -44.48 94.3 Favored 'General case' 0 CA--C 1.53 0.206 0 C-N-CA 125.338 1.455 . . . . 0.0 111.109 -178.977 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 27' ' ' ASP . . . . . . . . . . . . . 13.5 t70 -60.97 -46.08 92.17 Favored 'General case' 0 CA--C 1.514 -0.407 0 C-N-CA 125.64 1.576 . . . . 0.0 111.234 179.828 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 28' ' ' GLU . . . . . . . . . . . . . 87.6 tt0 -60.51 -48.18 82.9 Favored 'General case' 0 N--CA 1.448 -0.534 0 N-CA-C 108.387 -0.968 . . . . 0.0 108.387 179.098 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 39.2 m -57.02 -58.08 9.74 Favored 'General case' 0 CA--C 1.536 0.414 0 N-CA-C 109.449 -0.575 . . . . 0.0 109.449 179.522 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 63.4 mt -57.67 -44.02 84.75 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.314 0 C-N-CA 124.456 1.103 . . . . 0.0 111.093 -178.761 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 20.4 ttt180 -61.94 -49.55 75.69 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 119.133 0.879 . . . . 0.0 110.508 179.889 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 1.2 mptm? -62.75 -44.24 96.72 Favored 'General case' 0 CA--C 1.518 -0.252 0 O-C-N 123.463 0.477 . . . . 0.0 110.033 -178.102 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 36.3 tptt -67.94 -43.41 79.16 Favored 'General case' 0 C--O 1.221 -0.436 0 CA-C-O 118.714 -0.66 . . . . 0.0 111.155 -179.584 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 34' ' ' ALA . . . . . . . . . . . . . . . -57.64 -52.29 66.04 Favored 'General case' 0 C--N 1.329 -0.286 0 C-N-CA 124.029 0.932 . . . . 0.0 110.646 179.819 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 31.1 tp10 -63.36 -37.51 87.55 Favored 'General case' 0 CA--C 1.534 0.331 0 N-CA-C 110.46 -0.2 . . . . 0.0 110.46 -178.841 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 36' ' ' ASP . . . . . . . . . . . . . 34.8 t70 -69.28 -41.34 76.98 Favored 'General case' 0 C--O 1.232 0.156 0 C-N-CA 124.419 1.088 . . . . 0.0 111.038 179.741 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 37' ' ' SER . . . . . . . . . . . . . 1.4 t -70.16 -27.17 64.32 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 124.253 1.021 . . . . 0.0 108.886 179.23 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 85.71 22.4 50.26 Favored Glycine 0 CA--C 1.53 1.007 0 N-CA-C 109.959 -1.257 . . . . 0.0 109.959 -178.933 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 39' ' ' LEU . . . . . . . . . . . . . 86.9 mt -122.99 115.0 21.17 Favored 'General case' 0 CA--C 1.508 -0.661 0 N-CA-C 104.034 -2.58 . . . . 0.0 104.034 -179.823 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 40' ' ' THR . . . . . . . . . . . . . 9.0 t -51.9 158.57 1.01 Allowed 'General case' 0 CA--C 1.534 0.345 0 N-CA-C 109.741 -0.466 . . . . 0.0 109.741 179.299 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 41' ' ' VAL . . . . . . . . . . . . . 94.4 t -46.64 -42.11 5.38 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.294 0 C-N-CA 124.201 1.0 . . . . 0.0 112.086 -178.899 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 42' ' ' SER . . . . . 0.451 ' HA ' HD21 ' A' ' 20' ' ' LEU . 19.4 p -64.33 -46.79 81.96 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-N 120.516 1.507 . . . . 0.0 112.109 179.704 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.61 -46.46 85.64 Favored 'General case' 0 C--O 1.222 -0.389 0 C-N-CA 124.23 1.012 . . . . 0.0 108.721 179.119 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 44' ' ' TYR . . . . . . . . . . . . . 82.7 t80 -55.07 -52.98 61.52 Favored 'General case' 0 N--CA 1.447 -0.576 0 C-N-CA 124.399 1.08 . . . . 0.0 109.081 179.426 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 45' ' ' ILE . . . . . 0.508 HG23 HG23 ' A' ' 45' ' ' ILE . 11.0 mm -55.89 -62.25 0.89 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.25 0 C-N-CA 124.688 1.195 . . . . 0.0 111.504 179.781 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 46' ' ' ARG . . . . . . . . . . . . . 22.4 ptt180 -58.67 -39.27 80.15 Favored 'General case' 0 N--CA 1.454 -0.262 0 CA-C-O 117.809 -1.091 . . . . 0.0 112.847 -177.69 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 47' ' ' ASN . . . . . . . . . . . . . 29.2 t30 -65.12 -56.01 15.44 Favored 'General case' 0 C--N 1.332 -0.162 0 C-N-CA 124.255 1.022 . . . . 0.0 109.409 179.212 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -56.9 -29.27 62.86 Favored 'General case' 0 N--CA 1.454 -0.274 0 C-N-CA 124.453 1.101 . . . . 0.0 112.055 -179.385 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 49' ' ' ALA . . . . . . . . . . . . . . . -75.08 -25.6 58.69 Favored 'General case' 0 N--CA 1.445 -0.714 0 N-CA-C 113.748 1.018 . . . . 0.0 113.748 179.982 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 10.7 mt -93.72 -44.79 7.98 Favored 'General case' 0 C--O 1.238 0.461 0 C-N-CA 123.373 0.669 . . . . 0.0 109.226 -179.847 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 51' ' ' ASN . . . . . . . . . . . . . 73.0 m-20 . . . . . 0 C--O 1.251 1.132 0 C-N-CA 125.558 1.543 . . . . 0.0 109.99 -179.751 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 2.8 t . . . . . 0 N--CA 1.446 -0.673 0 N-CA-C 108.253 -1.017 . . . . 0.0 108.253 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . 0.407 HG21 ' HB2' ' B' ' 27' ' ' ASP . 6.2 t -132.48 148.74 31.78 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.657 0 N-CA-C 105.65 -1.982 . . . . 0.0 105.65 178.963 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 14.8 p -139.1 112.96 6.92 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.038 0 N-CA-C 105.815 -1.92 . . . . 0.0 105.815 178.02 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 17.7 ttt180 -140.93 178.81 7.1 Favored 'General case' 0 C--O 1.236 0.388 0 N-CA-C 107.549 -1.278 . . . . 0.0 107.549 -179.635 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 6.4 m -116.77 108.03 15.38 Favored 'General case' 0 C--O 1.237 0.414 0 N-CA-C 106.91 -1.515 . . . . 0.0 106.91 179.765 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.412 HD12 ' CZ ' ' A' ' 22' ' ' PHE . 0.0 OUTLIER -96.49 99.77 11.41 Favored 'General case' 0 C--O 1.235 0.308 0 N-CA-C 108.435 -0.95 . . . . 0.0 108.435 -178.94 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 1.2 mmt-85 -81.65 154.9 25.88 Favored 'General case' 0 C--O 1.235 0.316 0 C-N-CA 123.36 0.664 . . . . 0.0 109.484 179.094 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . 0.412 ' CZ ' HD12 ' A' ' 20' ' ' LEU . 96.9 m-85 -148.05 152.84 38.07 Favored 'General case' 0 CA--C 1.516 -0.344 0 C-N-CA 124.206 1.002 . . . . 0.0 108.644 178.633 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 14.5 m -79.49 167.04 37.25 Favored Pre-proline 0 CA--C 1.545 0.76 0 N-CA-C 107.496 -1.298 . . . . 0.0 107.496 178.603 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 34.5 Cg_endo -63.38 -43.01 19.41 Favored 'Trans proline' 0 N--CA 1.461 -0.418 0 C-N-CA 121.515 1.477 . . . . 0.0 112.025 -178.713 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 60.7 t -66.49 -39.36 83.81 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.557 0 C-N-CA 124.198 0.999 . . . . 0.0 109.921 179.795 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 97.5 mt-10 -63.7 -41.45 98.12 Favored 'General case' 0 N--CA 1.465 0.279 0 O-C-N 121.209 -0.932 . . . . 0.0 109.731 179.707 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . 0.502 ' HB2' HG21 ' B' ' 16' ' ' VAL . 27.1 t70 -68.19 -47.51 67.74 Favored 'General case' 0 C--O 1.218 -0.595 0 C-N-CA 124.445 1.098 . . . . 0.0 110.719 179.442 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -58.01 -34.26 69.83 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 118.692 0.678 . . . . 0.0 109.268 178.794 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 39.5 m -70.88 -60.71 2.09 Favored 'General case' 0 N--CA 1.45 -0.433 0 O-C-N 121.795 -0.566 . . . . 0.0 109.614 179.309 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 51.0 mt -58.73 -42.6 85.74 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.295 0 C-N-CA 123.765 0.826 . . . . 0.0 111.814 -178.247 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 59.7 ttt180 -64.27 -44.83 90.5 Favored 'General case' 0 N--CA 1.448 -0.538 0 CA-C-O 117.336 -1.316 . . . . 0.0 110.539 -179.481 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 2.1 mptp? -68.03 -44.73 75.8 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-N 119.863 1.211 . . . . 0.0 109.282 179.536 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 37.0 mmtt -55.93 -49.17 74.24 Favored 'General case' 0 CA--C 1.518 -0.253 0 C-N-CA 123.686 0.795 . . . . 0.0 110.609 -179.779 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -59.41 -53.8 54.05 Favored 'General case' 0 N--CA 1.444 -0.76 0 C-N-CA 125.419 1.487 . . . . 0.0 110.264 179.897 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 25.7 tt0 -57.76 -41.26 81.58 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 123.761 0.824 . . . . 0.0 110.805 -179.498 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 29.2 t70 -68.34 -40.24 81.61 Favored 'General case' 0 N--CA 1.463 0.201 0 C-N-CA 125.452 1.501 . . . . 0.0 109.95 179.663 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 22.5 t -73.06 -15.39 61.51 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 123.817 0.847 . . . . 0.0 109.647 178.356 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 75.21 0.82 62.34 Favored Glycine 0 CA--C 1.533 1.207 0 O-C-N 120.817 -1.177 . . . . 0.0 110.161 -178.189 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 40.7 mt -96.53 114.41 26.07 Favored 'General case' 0 N--CA 1.449 -0.49 0 N-CA-C 104.713 -2.329 . . . . 0.0 104.713 179.543 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 4.3 t -51.66 153.78 2.23 Favored 'General case' 0 CA--C 1.539 0.531 0 N-CA-C 109.475 -0.565 . . . . 0.0 109.475 179.336 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 55.8 t -44.88 -42.79 2.48 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.124 0 C-N-CA 124.964 1.306 . . . . 0.0 112.205 -178.805 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 1.6 p -63.22 -45.54 91.17 Favored 'General case' 0 CA--C 1.536 0.416 0 CA-C-N 119.034 0.834 . . . . 0.0 112.032 179.859 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -65.97 -45.37 81.93 Favored 'General case' 0 C--O 1.222 -0.38 0 C-N-CA 123.7 0.8 . . . . 0.0 109.083 178.777 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 65.1 t80 -56.07 -52.04 65.69 Favored 'General case' 0 N--CA 1.452 -0.361 0 C-N-CA 124.702 1.201 . . . . 0.0 109.11 179.888 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 3.9 mm -54.79 -62.66 0.7 Allowed 'Isoleucine or valine' 0 N--CA 1.457 -0.087 0 C-N-CA 124.91 1.284 . . . . 0.0 110.588 179.782 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 14.5 ptt180 -58.36 -46.66 85.87 Favored 'General case' 0 C--O 1.222 -0.369 0 CA-C-O 118.311 -0.852 . . . . 0.0 111.368 -178.195 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 22.0 t30 -56.66 -54.57 44.52 Favored 'General case' 0 C--O 1.225 -0.205 0 CA-C-N 119.181 0.901 . . . . 0.0 110.251 -179.748 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -60.25 -33.78 72.78 Favored 'General case' 0 N--CA 1.452 -0.337 0 N-CA-C 112.409 0.522 . . . . 0.0 112.409 -179.45 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -72.24 -40.89 67.39 Favored 'General case' 0 C--O 1.232 0.182 0 N-CA-C 113.049 0.759 . . . . 0.0 113.049 -179.154 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 14.7 mt -85.04 -37.03 20.83 Favored 'General case' 0 C--N 1.331 -0.232 0 C-N-CA 124.334 1.054 . . . . 0.0 113.295 -177.938 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 72.6 m-80 . . . . . 0 C--O 1.259 1.595 0 N-CA-C 113.684 0.994 . . . . 0.0 113.684 -177.095 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 10.5 t . . . . . 0 N--CA 1.449 -0.486 0 N-CA-C 108.302 -0.999 . . . . 0.0 108.302 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' B' B ' 16' ' ' VAL . . . . . 0.502 HG21 ' HB2' ' A' ' 27' ' ' ASP . 5.6 t -125.43 145.62 32.49 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.588 0 N-CA-C 106.518 -1.66 . . . . 0.0 106.518 179.575 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 9.4 p -137.82 119.1 17.43 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.365 0 N-CA-C 108.46 -0.941 . . . . 0.0 108.46 -179.932 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 17.8 ttt180 -149.43 157.9 43.7 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-O 120.519 0.2 . . . . 0.0 110.814 179.073 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 1.6 m -94.96 93.84 7.65 Favored 'General case' 0 N--CA 1.451 -0.413 0 C-N-CA 125.28 1.432 . . . . 0.0 107.917 179.934 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -95.49 94.8 8.0 Favored 'General case' 0 C--N 1.327 -0.409 0 C-N-CA 124.574 1.15 . . . . 0.0 108.869 -179.654 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 20.5 mmm-85 -76.47 147.68 37.71 Favored 'General case' 0 C--O 1.239 0.514 0 N-CA-C 108.799 -0.815 . . . . 0.0 108.799 179.273 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 22' ' ' PHE . . . . . . . . . . . . . 92.3 m-85 -136.0 153.46 51.37 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 124.674 1.19 . . . . 0.0 108.796 179.541 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 18.7 m -82.04 168.7 22.09 Favored Pre-proline 0 CA--C 1.541 0.614 0 C-N-CA 124.313 1.045 . . . . 0.0 109.74 179.232 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 24' ' ' PRO . . . . . . . . . . . . . 33.0 Cg_endo -64.36 -36.58 44.27 Favored 'Trans proline' 0 C--N 1.349 0.582 0 C-N-CA 121.658 1.572 . . . . 0.0 111.205 -179.391 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 25' ' ' VAL . . . . . . . . . . . . . 86.0 t -66.34 -45.54 89.27 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.211 0 N-CA-C 108.35 -0.981 . . . . 0.0 108.35 179.02 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 96.7 mt-10 -60.9 -49.58 76.88 Favored 'General case' 0 N--CA 1.455 -0.21 0 C-N-CA 123.62 0.768 . . . . 0.0 110.856 -179.319 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 27' ' ' ASP . . . . . 0.407 ' HB2' HG21 ' A' ' 16' ' ' VAL . 33.6 t70 -60.31 -53.27 59.65 Favored 'General case' 0 CA--C 1.502 -0.871 0 CA-C-O 117.401 -1.285 . . . . 0.0 111.751 -179.365 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 28' ' ' GLU . . . . . . . . . . . . . 24.2 mm-40 -57.53 -44.37 85.06 Favored 'General case' 0 N--CA 1.454 -0.258 0 CA-C-N 118.855 0.752 . . . . 0.0 109.012 -179.442 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 30.6 m -58.15 -53.05 62.65 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-N 118.536 0.607 . . . . 0.0 110.45 179.966 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 57.7 mt -61.74 -44.48 98.83 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.269 0 C-N-CA 124.323 1.049 . . . . 0.0 110.831 -179.414 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 24.7 ttt180 -62.62 -46.34 88.7 Favored 'General case' 0 C--N 1.325 -0.486 0 C-N-CA 126.204 1.801 . . . . 0.0 111.32 -178.902 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 4.7 mptp? -66.78 -42.84 85.41 Favored 'General case' 0 CA--C 1.518 -0.253 0 N-CA-C 108.9 -0.778 . . . . 0.0 108.9 -179.561 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 39.3 mmtt -63.15 -53.34 54.91 Favored 'General case' 0 C--O 1.222 -0.389 0 C-N-CA 123.496 0.718 . . . . 0.0 109.93 179.219 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 34' ' ' ALA . . . . . . . . . . . . . . . -52.51 -50.6 62.47 Favored 'General case' 0 C--O 1.236 0.359 0 C-N-CA 124.836 1.254 . . . . 0.0 111.394 -178.826 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -63.76 -39.95 95.51 Favored 'General case' 0 CA--C 1.532 0.258 0 CA-C-O 119.195 -0.431 . . . . 0.0 111.822 -179.573 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 36' ' ' ASP . . . . . . . . . . . . . 37.6 t70 -75.08 -30.73 61.02 Favored 'General case' 0 N--CA 1.465 0.317 0 C-N-CA 123.959 0.904 . . . . 0.0 112.931 -178.285 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 37' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -86.99 -6.13 58.86 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-O 118.156 -0.926 . . . . 0.0 112.459 -179.488 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 75.89 14.35 82.26 Favored Glycine 0 CA--C 1.534 1.262 0 CA-C-N 119.87 1.214 . . . . 0.0 114.172 179.348 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 39' ' ' LEU . . . . . . . . . . . . . 20.9 mt -121.68 112.27 18.22 Favored 'General case' 0 CA--C 1.517 -0.316 0 N-CA-C 105.828 -1.916 . . . . 0.0 105.828 179.623 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 40' ' ' THR . . . . . . . . . . . . . 14.1 t -52.05 156.11 1.67 Allowed 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 124.702 1.201 . . . . 0.0 109.561 179.163 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 41' ' ' VAL . . . . . . . . . . . . . 78.2 t -44.62 -47.39 2.61 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.232 0 C-N-CA 125.216 1.406 . . . . 0.0 112.566 -177.951 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 42' ' ' SER . . . . . . . . . . . . . 14.1 m -63.15 -47.45 82.63 Favored 'General case' 0 CA--C 1.543 0.696 0 CA-C-N 118.792 0.724 . . . . 0.0 111.523 -179.432 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -65.04 -43.3 92.84 Favored 'General case' 0 C--O 1.22 -0.476 0 C-N-CA 124.475 1.11 . . . . 0.0 109.788 178.644 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 44' ' ' TYR . . . . . . . . . . . . . 80.8 t80 -53.79 -53.72 48.35 Favored 'General case' 0 N--CA 1.455 -0.183 0 C-N-CA 125.515 1.526 . . . . 0.0 108.551 179.447 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 45' ' ' ILE . . . . . . . . . . . . . 18.5 mm -54.7 -61.21 1.07 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.226 0 C-N-CA 123.948 0.899 . . . . 0.0 111.202 179.595 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 46' ' ' ARG . . . . . . . . . . . . . 29.0 ptt180 -57.7 -45.23 85.98 Favored 'General case' 0 N--CA 1.466 0.374 0 O-C-N 121.975 -0.453 . . . . 0.0 111.345 -178.324 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 47' ' ' ASN . . . . . . . . . . . . . 35.2 t30 -57.91 -55.63 32.39 Favored 'General case' 0 N--CA 1.449 -0.504 0 C-N-CA 123.697 0.799 . . . . 0.0 111.436 -179.389 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -62.29 -32.01 72.68 Favored 'General case' 0 CA--C 1.529 0.171 0 C-N-CA 124.313 1.045 . . . . 0.0 112.385 -179.656 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 49' ' ' ALA . . . . . . . . . . . . . . . -77.14 -40.91 43.88 Favored 'General case' 0 N--CA 1.451 -0.394 0 N-CA-C 113.195 0.813 . . . . 0.0 113.195 -178.75 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 22.8 mt -74.18 -43.18 58.28 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 118.467 0.576 . . . . 0.0 111.685 -178.919 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 51' ' ' ASN . . . . . . . . . . . . . 53.3 m-80 . . . . . 0 C--O 1.254 1.326 0 CA-C-O 117.951 -1.023 . . . . 0.0 110.927 -179.785 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 4.8 t . . . . . 0 N--CA 1.447 -0.62 0 N-CA-C 109.333 -0.618 . . . . 0.0 109.333 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 9.3 t -109.96 84.5 0.73 Allowed 'Isoleucine or valine' 0 CA--C 1.513 -0.448 0 N-CA-C 109.765 -0.457 . . . . 0.0 109.765 -179.663 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 11.8 p -83.24 121.01 35.55 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.498 0 N-CA-C 105.502 -2.036 . . . . 0.0 105.502 178.107 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 13.0 ttt85 -157.07 163.21 39.26 Favored 'General case' 0 C--O 1.236 0.39 0 N-CA-C 107.79 -1.189 . . . . 0.0 107.79 179.042 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 2.2 m -102.14 130.71 48.84 Favored 'General case' 0 C--N 1.327 -0.413 0 N-CA-C 106.716 -1.587 . . . . 0.0 106.716 179.698 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -130.43 125.87 35.55 Favored 'General case' 0 N--CA 1.448 -0.533 0 N-CA-C 107.005 -1.48 . . . . 0.0 107.005 179.171 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 15.2 mtp180 -107.21 155.55 19.79 Favored 'General case' 0 N--CA 1.455 -0.219 0 C-N-CA 124.306 1.042 . . . . 0.0 111.136 179.666 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 35.5 m-85 -133.73 -171.41 2.71 Favored 'General case' 0 C--O 1.236 0.365 0 C-N-CA 125.567 1.547 . . . . 0.0 108.512 179.787 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 1.2 m -118.18 175.75 1.95 Allowed Pre-proline 0 CA--C 1.539 0.542 0 CA-C-O 117.218 -1.373 . . . . 0.0 107.668 179.433 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_endo -65.0 -51.06 1.77 Allowed 'Trans proline' 0 N--CA 1.458 -0.574 0 CA-C-N 121.458 1.556 . . . . 0.0 111.869 -178.368 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 57.9 t -59.46 -44.3 92.48 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.268 0 C-N-CA 124.713 1.205 . . . . 0.0 111.002 -179.823 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 3.9 mm-40 -65.8 -48.19 72.57 Favored 'General case' 0 C--N 1.331 -0.201 0 C-N-CA 123.852 0.861 . . . . 0.0 110.351 -178.572 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 7.6 t70 -61.42 -43.5 98.77 Favored 'General case' 0 CA--C 1.514 -0.431 0 C-N-CA 124.176 0.99 . . . . 0.0 110.865 179.641 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 45.6 tt0 -61.85 -48.76 79.1 Favored 'General case' 0 N--CA 1.448 -0.554 0 C-N-CA 125.035 1.334 . . . . 0.0 108.568 179.697 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 79.8 m -56.79 -51.72 67.83 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 123.378 0.671 . . . . 0.0 109.222 179.185 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 82.3 mt -62.86 -41.66 93.46 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.41 0 C-N-CA 123.592 0.757 . . . . 0.0 110.296 -179.372 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 14.9 ttt180 -62.44 -52.22 64.39 Favored 'General case' 0 CA--C 1.517 -0.291 0 O-C-N 121.042 -1.036 . . . . 0.0 110.083 -179.928 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 5.0 mptp? -57.69 -47.85 81.2 Favored 'General case' 0 N--CA 1.452 -0.33 0 CA-C-O 118.626 -0.702 . . . . 0.0 109.348 -179.113 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 50.4 mttp -68.46 -35.12 77.11 Favored 'General case' 0 C--O 1.223 -0.29 0 CA-C-O 117.871 -1.061 . . . . 0.0 111.952 -179.173 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -60.81 -52.44 65.08 Favored 'General case' 0 C--N 1.332 -0.162 0 N-CA-C 106.845 -1.539 . . . . 0.0 106.845 177.844 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 8.5 tt0 -62.39 -38.96 91.64 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-N 115.856 -0.611 . . . . 0.0 111.728 -179.389 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 49.6 t0 -66.02 -42.68 89.31 Favored 'General case' 0 N--CA 1.466 0.355 0 N-CA-C 107.959 -1.126 . . . . 0.0 107.959 179.022 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 20.8 t -61.6 -33.27 73.62 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 125.488 1.515 . . . . 0.0 108.102 178.885 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 91.27 38.23 6.02 Favored Glycine 0 N--CA 1.447 -0.583 0 N-CA-C 107.776 -2.13 . . . . 0.0 107.776 -179.032 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 69.1 mt -138.56 159.31 42.42 Favored 'General case' 0 N--CA 1.447 -0.592 0 C-N-CA 126.596 1.958 . . . . 0.0 108.92 -179.17 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 1.7 t -82.37 154.81 25.05 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 104.698 -2.334 . . . . 0.0 104.698 176.906 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 37.4 t -44.93 -42.78 2.51 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.428 0 C-N-CA 126.466 1.907 . . . . 0.0 110.598 178.796 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 6.7 p -58.74 -51.86 68.17 Favored 'General case' 0 CA--C 1.531 0.244 0 CA-C-N 119.66 1.118 . . . . 0.0 111.644 179.52 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -61.15 -47.78 84.64 Favored 'General case' 0 N--CA 1.455 -0.196 0 C-N-CA 124.728 1.211 . . . . 0.0 109.731 179.195 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 77.3 t80 -55.32 -47.17 76.05 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 124.369 1.068 . . . . 0.0 109.5 179.581 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 3.0 mm -57.42 -66.53 0.32 Allowed 'Isoleucine or valine' 0 C--O 1.225 -0.225 0 C-N-CA 125.267 1.427 . . . . 0.0 110.03 179.327 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 9.2 ptm180 -54.37 -40.98 68.64 Favored 'General case' 0 C--O 1.22 -0.472 0 CA-C-O 118.001 -1.0 . . . . 0.0 112.914 -178.501 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 34.9 t30 -68.97 -45.12 71.47 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 119.642 1.11 . . . . 0.0 112.4 -179.339 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -64.76 -33.4 75.9 Favored 'General case' 0 C--O 1.224 -0.288 0 CA-C-N 118.468 0.576 . . . . 0.0 109.943 178.869 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -72.84 -14.25 61.46 Favored 'General case' 0 N--CA 1.453 -0.305 0 C-N-CA 124.199 0.999 . . . . 0.0 112.99 -179.375 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 20.7 mt -100.47 -40.88 7.23 Favored 'General case' 0 CA--C 1.509 -0.626 0 CA-C-O 118.277 -0.868 . . . . 0.0 109.9 178.826 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 70.0 m-80 . . . . . 0 C--O 1.251 1.178 0 O-C-N 124.455 1.097 . . . . 0.0 110.687 179.519 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 10.9 t . . . . . 0 N--CA 1.45 -0.458 0 N-CA-C 108.435 -0.95 . . . . 0.0 108.435 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 2.8 t -136.12 88.9 0.75 Allowed 'Isoleucine or valine' 0 N--CA 1.447 -0.594 0 N-CA-C 106.948 -1.501 . . . . 0.0 106.948 -179.593 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 8.3 p -85.5 103.7 12.68 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.447 0 N-CA-C 104.751 -2.314 . . . . 0.0 104.751 178.689 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 36.1 ttt85 -137.66 165.57 26.06 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 108.376 -0.972 . . . . 0.0 108.376 -179.669 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 35.1 m -112.67 120.66 42.31 Favored 'General case' 0 N--CA 1.449 -0.483 0 N-CA-C 105.275 -2.12 . . . . 0.0 105.275 179.696 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -118.75 111.71 18.82 Favored 'General case' 0 CA--C 1.517 -0.317 0 C-N-CA 123.699 0.799 . . . . 0.0 109.686 -178.242 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 62.0 mtm180 -90.08 153.91 20.19 Favored 'General case' 0 N--CA 1.454 -0.259 0 CA-C-O 121.225 0.536 . . . . 0.0 111.283 179.362 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 22' ' ' PHE . . . . . . . . . . . . . 63.9 m-85 -139.33 162.36 35.19 Favored 'General case' 0 C--O 1.235 0.298 0 C-N-CA 126.833 2.053 . . . . 0.0 107.256 -179.588 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -94.86 177.82 1.7 Allowed Pre-proline 0 CA--C 1.546 0.824 0 N-CA-C 108.463 -0.939 . . . . 0.0 108.463 179.069 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 24' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -71.32 -23.47 24.03 Favored 'Trans proline' 0 N--CA 1.461 -0.402 0 C-N-CA 121.583 1.522 . . . . 0.0 114.458 -177.843 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 25' ' ' VAL . . . . . . . . . . . . . 98.6 t -75.35 -45.7 39.93 Favored 'Isoleucine or valine' 0 C--O 1.235 0.327 0 N-CA-C 107.608 -1.256 . . . . 0.0 107.608 179.823 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -63.67 -40.81 97.77 Favored 'General case' 0 N--CA 1.451 -0.419 0 CA-C-O 119.207 -0.425 . . . . 0.0 110.398 179.22 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 27' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -62.43 -48.08 81.23 Favored 'General case' 0 CA--C 1.51 -0.564 0 C-N-CA 123.289 0.635 . . . . 0.0 111.494 -179.702 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 28' ' ' GLU . . . . . . . . . . . . . 29.3 tt0 -60.34 -49.28 78.22 Favored 'General case' 0 N--CA 1.449 -0.524 0 N-CA-C 108.679 -0.859 . . . . 0.0 108.679 179.15 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 49.6 m -58.23 -57.21 13.89 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 122.701 0.4 . . . . 0.0 110.131 -179.818 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 55.4 mt -56.5 -47.23 82.12 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.272 0 C-N-CA 124.08 0.952 . . . . 0.0 110.888 -179.253 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 23.3 ttt-85 -62.23 -44.57 96.27 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 118.378 -0.82 . . . . 0.0 111.367 -178.922 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 1.7 mptm? -61.9 -50.89 70.37 Favored 'General case' 0 C--O 1.226 -0.167 0 CA-C-N 118.618 0.644 . . . . 0.0 109.406 179.4 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 4.6 mptp? -62.53 -42.69 99.69 Favored 'General case' 0 N--CA 1.466 0.354 0 C-N-CA 123.193 0.597 . . . . 0.0 111.57 -179.023 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 34' ' ' ALA . . . . . . . . . . . . . . . -58.6 -53.06 62.59 Favored 'General case' 0 N--CA 1.451 -0.405 0 C-N-CA 123.645 0.778 . . . . 0.0 109.521 179.436 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 14.1 tt0 -62.35 -39.97 94.86 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-O 118.689 -0.672 . . . . 0.0 111.335 -178.037 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 36' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -60.59 -46.57 89.75 Favored 'General case' 0 CA--C 1.516 -0.34 0 C-N-CA 126.385 1.874 . . . . 0.0 108.33 179.099 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 37' ' ' SER . . . . . . . . . . . . . 6.3 t -73.22 -14.35 61.32 Favored 'General case' 0 N--CA 1.451 -0.399 0 C-N-CA 120.935 -0.306 . . . . 0.0 110.934 -179.686 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 81.92 2.97 90.71 Favored Glycine 0 CA--C 1.528 0.9 0 CA-C-O 118.713 -1.048 . . . . 0.0 111.71 -179.479 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 39' ' ' LEU . . . . . . . . . . . . . 64.0 mt -100.2 123.36 44.33 Favored 'General case' 0 N--CA 1.445 -0.698 0 C-N-CA 127.627 2.371 . . . . 0.0 106.269 -179.4 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 40' ' ' THR . . . . . . . . . . . . . 11.7 t -54.38 153.63 5.3 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 108.791 -0.818 . . . . 0.0 108.791 178.753 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 41' ' ' VAL . . . . . . . . . . . . . 56.1 t -47.6 -43.35 9.25 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.326 0 C-N-CA 124.768 1.227 . . . . 0.0 111.874 -179.21 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 42' ' ' SER . . . . . . . . . . . . . 2.1 p -61.26 -44.95 96.41 Favored 'General case' 0 CA--C 1.535 0.366 0 O-C-N 121.499 -0.751 . . . . 0.0 111.392 179.397 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -65.63 -44.29 86.89 Favored 'General case' 0 C--O 1.224 -0.271 0 C-N-CA 123.587 0.755 . . . . 0.0 108.98 178.692 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 44' ' ' TYR . . . . . . . . . . . . . 64.2 t80 -53.79 -50.5 65.95 Favored 'General case' 0 N--CA 1.454 -0.262 0 C-N-CA 124.654 1.182 . . . . 0.0 109.955 179.684 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 45' ' ' ILE . . . . . . . . . . . . . 10.0 mm -55.41 -62.48 0.79 Allowed 'Isoleucine or valine' 0 N--CA 1.463 0.196 0 C-N-CA 123.984 0.914 . . . . 0.0 111.41 179.853 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 46' ' ' ARG . . . . . . . . . . . . . 7.3 ptm180 -56.89 -40.64 76.61 Favored 'General case' 0 C--O 1.223 -0.342 0 CA-C-O 119.041 -0.504 . . . . 0.0 111.03 -179.045 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 47' ' ' ASN . . . . . . . . . . . . . 24.3 t30 -60.75 -55.38 33.89 Favored 'General case' 0 N--CA 1.449 -0.51 0 C-N-CA 123.677 0.791 . . . . 0.0 110.417 -179.583 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -61.46 -31.23 71.18 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 123.783 0.833 . . . . 0.0 112.382 -179.659 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 49' ' ' ALA . . . . . . . . . . . . . . . -75.27 -21.17 58.73 Favored 'General case' 0 N--CA 1.447 -0.595 0 N-CA-C 113.807 1.04 . . . . 0.0 113.807 -179.322 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 20.8 mt -101.12 -36.09 9.09 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-N 118.577 0.626 . . . . 0.0 110.468 -179.883 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 51' ' ' ASN . . . . . . . . . . . . . 58.0 m-80 . . . . . 0 C--O 1.246 0.898 0 CA-C-O 117.319 -1.324 . . . . 0.0 110.103 179.88 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 3.4 t . . . . . 0 N--CA 1.44 -0.925 0 CA-C-O 123.342 1.544 . . . . 0.0 109.153 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 3.1 t -142.08 143.37 26.67 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.881 0 N-CA-C 102.993 -2.966 . . . . 0.0 102.993 178.328 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 8.6 p -139.04 119.73 15.25 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.064 0 N-CA-C 106.409 -1.7 . . . . 0.0 106.409 178.77 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 52.6 ttm-85 -139.08 158.31 44.41 Favored 'General case' 0 CA--C 1.51 -0.568 0 CA-C-N 114.773 -1.103 . . . . 0.0 109.3 179.487 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 19.6 m -104.74 97.43 7.32 Favored 'General case' 0 N--CA 1.445 -0.68 0 N-CA-C 100.379 -3.934 . . . . 0.0 100.379 178.05 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 53.3 tp -109.9 92.29 3.99 Favored 'General case' 0 N--CA 1.448 -0.532 0 C-N-CA 125.964 1.706 . . . . 0.0 111.537 -178.038 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.414 ' HA ' ' O ' ' B' ' 16' ' ' VAL . 8.3 mpt_? -66.78 156.08 36.47 Favored 'General case' 0 N--CA 1.44 -0.966 0 C-N-CA 123.94 0.896 . . . . 0.0 110.151 177.054 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 62.7 m-85 -131.48 147.53 52.56 Favored 'General case' 0 N--CA 1.466 0.355 0 N-CA-C 104.125 -2.546 . . . . 0.0 104.125 177.25 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 1.1 m -76.83 169.52 20.74 Favored Pre-proline 0 CA--C 1.545 0.757 0 N-CA-C 109.07 -0.715 . . . . 0.0 109.07 -179.004 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 59.5 Cg_endo -67.17 -32.25 34.27 Favored 'Trans proline' 0 C--N 1.345 0.377 0 C-N-CA 121.946 1.764 . . . . 0.0 113.584 -178.562 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 55.9 t -74.29 -49.31 32.83 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.174 0 N-CA-C 107.471 -1.307 . . . . 0.0 107.471 179.228 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 2.4 mp0 -56.24 -46.07 79.74 Favored 'General case' 0 N--CA 1.449 -0.514 0 C-N-CA 124.825 1.25 . . . . 0.0 108.976 179.578 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -62.26 -48.05 81.64 Favored 'General case' 0 CA--C 1.512 -0.51 0 C-N-CA 123.874 0.87 . . . . 0.0 111.999 179.58 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 39.7 tt0 -59.2 -48.4 81.75 Favored 'General case' 0 N--CA 1.452 -0.35 0 N-CA-C 108.896 -0.779 . . . . 0.0 108.896 -179.888 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 51.9 m -59.04 -55.18 38.45 Favored 'General case' 0 N--CA 1.455 -0.206 0 C-N-CA 123.585 0.754 . . . . 0.0 109.213 179.377 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 90.3 mt -58.5 -41.53 82.02 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.245 0 C-N-CA 123.327 0.651 . . . . 0.0 110.366 -179.176 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 54.5 ttt180 -60.62 -49.9 75.69 Favored 'General case' 0 N--CA 1.462 0.15 0 CA-C-N 119.301 0.955 . . . . 0.0 108.981 179.038 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 5.2 mptp? -58.16 -53.02 62.99 Favored 'General case' 0 C--O 1.225 -0.206 0 N-CA-C 109.077 -0.712 . . . . 0.0 109.077 179.578 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -59.99 -43.19 95.31 Favored 'General case' 0 CA--C 1.517 -0.304 0 C-N-CA 123.342 0.657 . . . . 0.0 112.173 -178.64 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -63.76 -48.63 76.17 Favored 'General case' 0 N--CA 1.446 -0.635 0 C-N-CA 124.441 1.096 . . . . 0.0 110.244 -179.787 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 27.7 tt0 -67.06 -32.92 74.43 Favored 'General case' 0 CA--C 1.533 0.297 0 O-C-N 121.364 -0.835 . . . . 0.0 110.877 179.891 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 8.1 t70 -70.17 -44.79 68.03 Favored 'General case' 0 CA--C 1.514 -0.437 0 C-N-CA 124.334 1.054 . . . . 0.0 108.857 -178.986 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 22.7 t -75.63 -9.8 58.9 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 124.78 1.232 . . . . 0.0 110.324 178.678 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 74.14 -6.89 18.91 Favored Glycine 0 CA--C 1.532 1.153 0 CA-C-O 118.845 -0.975 . . . . 0.0 111.014 -178.632 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 44.1 mt -88.41 119.17 28.59 Favored 'General case' 0 CA--C 1.513 -0.479 0 CA-C-N 119.89 1.845 . . . . 0.0 107.316 -179.429 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 5.2 t -48.37 151.36 1.08 Allowed 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 124.396 1.078 . . . . 0.0 109.768 178.884 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 41.6 t -46.72 -45.26 7.27 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.315 0 C-N-CA 125.018 1.327 . . . . 0.0 111.447 -178.762 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 54.3 m -61.2 -47.45 86.07 Favored 'General case' 0 CA--C 1.539 0.55 0 O-C-N 121.453 -0.78 . . . . 0.0 111.644 179.705 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -64.96 -44.16 90.29 Favored 'General case' 0 C--O 1.223 -0.317 0 C-N-CA 123.828 0.851 . . . . 0.0 109.36 178.787 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 80.8 t80 -55.12 -51.27 66.96 Favored 'General case' 0 N--CA 1.45 -0.471 0 C-N-CA 124.899 1.28 . . . . 0.0 109.837 179.725 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 12.1 mm -55.56 -65.86 0.33 Allowed 'Isoleucine or valine' 0 C--N 1.339 0.132 0 C-N-CA 124.897 1.279 . . . . 0.0 110.416 179.734 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 11.5 ptt180 -55.6 -44.94 77.45 Favored 'General case' 0 C--O 1.22 -0.452 0 CA-C-O 117.894 -1.05 . . . . 0.0 111.843 -178.241 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 30.8 t30 -58.35 -52.1 67.03 Favored 'General case' 0 CA--C 1.529 0.148 0 CA-C-N 119.322 0.964 . . . . 0.0 110.133 179.653 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -61.29 -30.84 70.73 Favored 'General case' 0 CA--C 1.533 0.316 0 N-CA-C 112.246 0.462 . . . . 0.0 112.246 179.749 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -82.37 -32.2 29.37 Favored 'General case' 0 C--O 1.222 -0.355 0 N-CA-C 114.817 1.414 . . . . 0.0 114.817 -178.969 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 22.1 mt -81.8 -41.58 20.92 Favored 'General case' 0 CA--C 1.508 -0.667 0 N-CA-C 113.944 1.09 . . . . 0.0 113.944 -177.551 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 69.5 m-80 . . . . . 0 C--O 1.251 1.141 0 CA-C-O 117.661 -1.162 . . . . 0.0 109.054 -178.896 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 1.3 t . . . . . 0 N--CA 1.444 -0.726 0 CA-C-O 122.032 0.92 . . . . 0.0 108.83 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' B' B ' 16' ' ' VAL . . . . . 0.414 ' O ' ' HA ' ' A' ' 21' ' ' ARG . 19.4 t -114.39 142.75 25.97 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.573 0 N-CA-C 105.771 -1.937 . . . . 0.0 105.771 179.325 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 12.4 p -135.8 108.93 9.17 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 N-CA-C 106.188 -1.782 . . . . 0.0 106.188 178.675 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 43.4 ttm-85 -134.38 150.04 50.87 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-N 115.855 -0.612 . . . . 0.0 110.1 -179.745 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 22.5 m -88.57 75.45 8.32 Favored 'General case' 0 N--CA 1.45 -0.459 0 C-N-CA 125.264 1.426 . . . . 0.0 108.265 179.801 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 16.6 tp -86.44 136.99 32.9 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 105.947 -1.872 . . . . 0.0 105.947 178.818 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 78.9 mtt180 -132.62 166.75 21.42 Favored 'General case' 0 N--CA 1.451 -0.42 0 C-N-CA 127.182 2.193 . . . . 0.0 110.094 -179.078 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 22' ' ' PHE . . . . . . . . . . . . . 87.6 m-85 -136.76 -178.04 5.01 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 124.611 1.164 . . . . 0.0 110.114 -179.721 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -105.83 173.48 3.2 Favored Pre-proline 0 CA--C 1.542 0.663 0 C-N-CA 124.181 0.992 . . . . 0.0 109.751 179.758 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 24' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -68.32 -37.83 12.99 Favored 'Trans proline' 0 C--N 1.347 0.471 0 C-N-CA 121.55 1.5 . . . . 0.0 114.371 -177.494 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 25' ' ' VAL . . . . . . . . . . . . . 81.6 t -74.97 -41.6 45.93 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.202 0 N-CA-C 108.793 -0.818 . . . . 0.0 108.793 179.489 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -60.39 -51.71 68.32 Favored 'General case' 0 N--CA 1.45 -0.469 0 C-N-CA 126.559 1.944 . . . . 0.0 109.941 -178.776 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 27' ' ' ASP . . . . . . . . . . . . . 16.8 t70 -61.11 -49.85 75.64 Favored 'General case' 0 CA--C 1.512 -0.515 0 C-N-CA 124.732 1.213 . . . . 0.0 110.676 179.601 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 28' ' ' GLU . . . . . . . . . . . . . 31.1 tt0 -58.85 -45.23 90.58 Favored 'General case' 0 N--CA 1.447 -0.601 0 N-CA-C 109.106 -0.701 . . . . 0.0 109.106 -179.757 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 99.1 m -59.97 -55.93 27.93 Favored 'General case' 0 CA--C 1.53 0.199 0 CA-C-N 118.677 0.671 . . . . 0.0 109.288 179.062 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 65.6 mt -55.6 -42.93 71.0 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.215 0 C-N-CA 123.012 0.525 . . . . 0.0 109.912 -179.76 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 77.3 ttt180 -64.41 -44.6 90.73 Favored 'General case' 0 N--CA 1.45 -0.442 0 CA-C-O 118.336 -0.84 . . . . 0.0 111.246 -179.185 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 1.6 mptp? -62.69 -47.19 84.73 Favored 'General case' 0 C--O 1.222 -0.363 0 CA-C-O 118.101 -0.952 . . . . 0.0 109.062 179.579 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 1.5 mptm? -61.83 -47.82 83.37 Favored 'General case' 0 CA--C 1.518 -0.272 0 CA-C-N 119.48 1.036 . . . . 0.0 110.369 -179.736 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 34' ' ' ALA . . . . . . . . . . . . . . . -54.63 -57.86 9.79 Favored 'General case' 0 N--CA 1.448 -0.554 0 C-N-CA 124.94 1.296 . . . . 0.0 109.866 179.456 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 41.3 tt0 -61.81 -41.59 97.95 Favored 'General case' 0 N--CA 1.464 0.273 0 C-N-CA 124.649 1.18 . . . . 0.0 112.271 -178.946 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 36' ' ' ASP . . . . . . . . . . . . . 4.8 t70 -61.02 -42.32 98.24 Favored 'General case' 0 C--N 1.332 -0.184 0 C-N-CA 124.613 1.165 . . . . 0.0 108.393 179.617 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 37' ' ' SER . . . . . . . . . . . . . 29.5 t -77.68 -7.82 57.01 Favored 'General case' 0 N--CA 1.445 -0.684 0 C-N-CA 124.598 1.159 . . . . 0.0 110.839 179.107 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 77.13 15.05 81.97 Favored Glycine 0 CA--C 1.523 0.563 0 CA-C-O 117.061 -1.966 . . . . 0.0 115.998 178.895 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 39' ' ' LEU . . . . . . . . . . . . . 8.3 mt -120.68 143.37 48.76 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-N 120.892 2.346 . . . . 0.0 106.214 179.542 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 40' ' ' THR . . . . . . . . . . . . . 10.1 t -63.85 152.16 40.42 Favored 'General case' 0 C--N 1.321 -0.671 0 O-C-N 120.964 -1.085 . . . . 0.0 108.393 178.939 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 41' ' ' VAL . . . . . . . . . . . . . 52.6 t -48.07 -42.02 10.27 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.254 0 C-N-CA 125.267 1.427 . . . . 0.0 111.452 179.319 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 42' ' ' SER . . . . . . . . . . . . . 70.7 m -57.94 -43.09 86.14 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-N 120.301 1.409 . . . . 0.0 111.716 179.923 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -65.11 -51.04 63.63 Favored 'General case' 0 N--CA 1.452 -0.345 0 N-CA-C 107.529 -1.286 . . . . 0.0 107.529 178.087 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 44' ' ' TYR . . . . . . . . . . . . . 69.5 t80 -53.98 -45.71 71.49 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 123.548 0.739 . . . . 0.0 111.362 -179.647 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 45' ' ' ILE . . . . . . . . . . . . . 16.0 mm -59.47 -68.43 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.34 0.184 0 C-N-CA 125.352 1.461 . . . . 0.0 109.904 179.718 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 46' ' ' ARG . . . . . . . . . . . . . 17.8 ptt85 -51.65 -44.92 63.18 Favored 'General case' 0 C--O 1.219 -0.538 0 CA-C-O 118.971 -0.538 . . . . 0.0 110.537 -178.373 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 47' ' ' ASN . . . . . . . . . . . . . 32.4 t30 -62.43 -47.78 82.56 Favored 'General case' 0 N--CA 1.444 -0.758 0 CA-C-O 117.639 -1.172 . . . . 0.0 112.47 -179.008 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -64.41 -29.14 70.2 Favored 'General case' 0 CA--C 1.531 0.237 0 CA-C-N 119.115 0.87 . . . . 0.0 110.514 179.544 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 49' ' ' ALA . . . . . . . . . . . . . . . -73.75 -21.28 60.25 Favored 'General case' 0 CA--C 1.539 0.522 0 N-CA-C 112.494 0.554 . . . . 0.0 112.494 179.575 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 6.3 mt -101.33 -33.79 9.88 Favored 'General case' 0 N--CA 1.463 0.223 0 C-N-CA 124.532 1.133 . . . . 0.0 109.783 -179.085 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 51' ' ' ASN . . . . . . . . . . . . . 69.4 m-80 . . . . . 0 C--O 1.253 1.263 0 C-N-CA 125.671 1.589 . . . . 0.0 109.11 178.984 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 3.9 t . . . . . 0 N--CA 1.447 -0.587 0 N-CA-C 108.605 -0.887 . . . . 0.0 108.605 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 4.1 t -109.0 138.77 34.58 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.635 0 N-CA-C 103.65 -2.722 . . . . 0.0 103.65 178.164 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 11.5 p -140.73 117.26 7.9 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.388 0 N-CA-C 106.639 -1.615 . . . . 0.0 106.639 178.89 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 33.3 ttt180 -150.19 173.31 14.07 Favored 'General case' 0 C--O 1.236 0.375 0 N-CA-C 107.835 -1.172 . . . . 0.0 107.835 -179.782 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 27.1 m -111.46 120.35 41.87 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 104.895 -2.261 . . . . 0.0 104.895 179.078 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -120.62 104.68 10.12 Favored 'General case' 0 N--CA 1.449 -0.511 0 N-CA-C 106.32 -1.733 . . . . 0.0 106.32 179.484 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 26.3 mtm-85 -84.98 157.16 20.86 Favored 'General case' 0 N--CA 1.448 -0.543 0 N-CA-C 109.662 -0.495 . . . . 0.0 109.662 178.874 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 97.5 m-85 -137.66 163.42 31.3 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 108.321 -0.992 . . . . 0.0 108.321 179.936 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 19.3 m -91.98 168.3 13.32 Favored Pre-proline 0 CA--C 1.547 0.834 0 CA-C-O 118.154 -0.927 . . . . 0.0 108.53 179.734 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 45.8 Cg_endo -63.14 -41.97 25.41 Favored 'Trans proline' 0 C--N 1.348 0.529 0 C-N-CA 121.72 1.613 . . . . 0.0 113.03 -177.499 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 65.6 t -68.2 -26.61 34.52 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.363 0 C-N-CA 123.963 0.905 . . . . 0.0 110.561 -179.654 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 4.2 mm-40 -81.65 -38.12 26.42 Favored 'General case' 0 C--N 1.333 -0.124 0 C-N-CA 124.083 0.953 . . . . 0.0 109.572 -179.297 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -69.04 -44.08 73.38 Favored 'General case' 0 C--O 1.221 -0.416 0 C-N-CA 125.429 1.492 . . . . 0.0 108.636 178.626 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 24.6 tt0 -54.22 -52.32 61.64 Favored 'General case' 0 N--CA 1.451 -0.382 0 C-N-CA 126.615 1.966 . . . . 0.0 109.455 179.064 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 72.8 m -65.79 -52.01 54.31 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-O 118.969 -0.538 . . . . 0.0 110.915 -179.4 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 71.1 mt -58.53 -41.75 82.71 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.261 0 CA-C-N 118.191 0.451 . . . . 0.0 110.611 -178.694 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 50.7 ttt85 -64.94 -48.66 73.32 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-O 118.868 -0.586 . . . . 0.0 110.352 -179.516 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 11.7 mptt -63.87 -46.88 82.97 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-O 118.737 -0.649 . . . . 0.0 111.002 -179.243 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.8 -43.38 98.95 Favored 'General case' 0 C--O 1.228 -0.041 0 CA-C-N 118.63 0.65 . . . . 0.0 110.218 -179.508 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -59.16 -52.74 64.42 Favored 'General case' 0 N--CA 1.454 -0.25 0 C-N-CA 123.842 0.857 . . . . 0.0 110.128 179.455 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 18.0 tt0 -59.39 -39.25 82.74 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 123.392 0.677 . . . . 0.0 111.784 -178.896 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -71.3 -40.91 70.56 Favored 'General case' 0 N--CA 1.463 0.196 0 CA-C-N 118.416 0.553 . . . . 0.0 109.913 178.841 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 23.1 t -69.38 -9.04 51.72 Favored 'General case' 0 N--CA 1.448 -0.542 0 C-N-CA 123.606 0.762 . . . . 0.0 110.66 179.788 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 67.42 20.74 71.88 Favored Glycine 0 CA--C 1.527 0.83 0 CA-C-N 119.061 0.846 . . . . 0.0 111.064 -179.203 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 70.6 mt -117.71 116.79 27.74 Favored 'General case' 0 CA--C 1.513 -0.474 0 N-CA-C 104.148 -2.538 . . . . 0.0 104.148 179.791 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 5.2 t -54.24 152.2 6.48 Favored 'General case' 0 CA--C 1.539 0.533 0 N-CA-C 108.551 -0.907 . . . . 0.0 108.551 179.171 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 53.1 t -45.71 -43.25 4.08 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.224 0 C-N-CA 124.02 0.928 . . . . 0.0 111.629 -179.479 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 8.9 p -59.35 -47.03 86.94 Favored 'General case' 0 CA--C 1.536 0.42 0 O-C-N 121.58 -0.7 . . . . 0.0 111.614 -179.954 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -67.01 -43.25 83.36 Favored 'General case' 0 N--CA 1.454 -0.226 0 C-N-CA 124.454 1.102 . . . . 0.0 109.967 178.992 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 36.2 t80 -53.74 -51.38 63.54 Favored 'General case' 0 N--CA 1.453 -0.319 0 C-N-CA 125.265 1.426 . . . . 0.0 109.137 179.684 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 8.3 mm -53.82 -63.21 0.55 Allowed 'Isoleucine or valine' 0 CA--C 1.529 0.14 0 C-N-CA 124.668 1.187 . . . . 0.0 110.093 179.733 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 6.9 ptm180 -56.83 -44.99 82.6 Favored 'General case' 0 C--O 1.224 -0.28 0 CA-C-O 118.296 -0.859 . . . . 0.0 112.718 -178.744 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 25.5 t30 -59.55 -53.07 62.38 Favored 'General case' 0 C--O 1.232 0.143 0 C-N-CA 124.449 1.1 . . . . 0.0 110.468 -179.912 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -62.67 -33.09 74.36 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 123.316 0.646 . . . . 0.0 111.324 179.834 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -75.26 -15.34 60.53 Favored 'General case' 0 CA--C 1.536 0.421 0 N-CA-C 114.128 1.158 . . . . 0.0 114.128 -179.673 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 17.6 mt -107.05 -34.77 7.07 Favored 'General case' 0 CA--C 1.517 -0.297 0 CA-C-N 119.426 1.012 . . . . 0.0 112.418 -179.889 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 56.2 m-80 . . . . . 0 C--O 1.247 0.968 0 C-N-CA 123.654 0.782 . . . . 0.0 111.595 -178.981 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 4.1 t . . . . . 0 N--CA 1.439 -0.985 0 CA-C-O 122.142 0.972 . . . . 0.0 110.548 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 36.0 t -101.51 152.42 5.27 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 N-CA-C 105.409 -2.071 . . . . 0.0 105.409 178.422 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 11.1 p -147.66 110.82 0.72 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 N-CA-C 103.501 -2.777 . . . . 0.0 103.501 178.121 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 32.2 ttt180 -145.0 158.71 43.73 Favored 'General case' 0 C--O 1.233 0.197 0 O-C-N 121.274 -0.891 . . . . 0.0 113.299 -178.425 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 3.9 m -92.23 80.18 5.03 Favored 'General case' 0 N--CA 1.451 -0.377 0 C-N-CA 125.998 1.719 . . . . 0.0 107.812 -179.361 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -85.62 93.02 8.72 Favored 'General case' 0 C--N 1.326 -0.439 0 O-C-N 121.32 -0.863 . . . . 0.0 109.102 -179.453 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 14.5 mmm-85 -78.44 154.2 30.82 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 122.987 0.515 . . . . 0.0 110.179 179.101 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 22' ' ' PHE . . . . . . . . . . . . . 92.0 m-85 -141.35 174.18 10.78 Favored 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 125.506 1.522 . . . . 0.0 108.269 179.139 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 23' ' ' SER . . . . . 0.448 ' HB3' ' HD2' ' B' ' 24' ' ' PRO . 3.2 m -104.25 176.66 1.67 Allowed Pre-proline 0 CA--C 1.544 0.716 0 CA-C-O 117.809 -1.091 . . . . 0.0 110.124 179.562 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 24' ' ' PRO . . . . . 0.448 ' HD2' ' HB3' ' B' ' 23' ' ' SER . 85.7 Cg_endo -77.17 -29.0 5.35 Favored 'Trans proline' 0 C--N 1.35 0.62 0 CA-C-N 121.519 1.578 . . . . 0.0 112.634 -178.107 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 25' ' ' VAL . . . . . . . . . . . . . 11.4 t -75.66 -34.66 29.34 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.177 0 N-CA-C 107.295 -1.372 . . . . 0.0 107.295 179.237 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -69.08 -45.63 69.8 Favored 'General case' 0 N--CA 1.447 -0.595 0 N-CA-C 107.48 -1.304 . . . . 0.0 107.48 178.41 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 27' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -60.7 -49.3 78.05 Favored 'General case' 0 C--O 1.218 -0.601 0 N-CA-C 109.194 -0.669 . . . . 0.0 109.194 179.097 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 28' ' ' GLU . . . . . . . . . . . . . 36.4 tt0 -61.32 -23.03 65.43 Favored 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 123.965 0.906 . . . . 0.0 111.48 -179.806 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 88.6 m -85.21 -53.92 4.94 Favored 'General case' 0 N--CA 1.452 -0.35 0 N-CA-C 108.035 -1.098 . . . . 0.0 108.035 178.616 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 58.8 mt -58.43 -46.16 89.57 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.507 0 C-N-CA 124.591 1.156 . . . . 0.0 110.18 -179.278 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 54.0 ttt85 -59.98 -52.33 65.87 Favored 'General case' 0 N--CA 1.451 -0.387 0 C-N-CA 124.299 1.04 . . . . 0.0 110.142 -179.456 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 5.9 mptt -59.42 -48.44 81.65 Favored 'General case' 0 N--CA 1.456 -0.164 0 O-C-N 123.711 0.632 . . . . 0.0 110.499 -179.073 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -67.02 -38.46 86.0 Favored 'General case' 0 C--O 1.226 -0.158 0 CA-C-N 118.123 0.42 . . . . 0.0 112.085 -178.586 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 34' ' ' ALA . . . . . . . . . . . . . . . -59.94 -52.81 63.82 Favored 'General case' 0 N--CA 1.452 -0.371 0 C-N-CA 124.015 0.926 . . . . 0.0 108.79 179.034 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 5.9 tt0 -65.73 -30.84 71.57 Favored 'General case' 0 CA--C 1.534 0.348 0 O-C-N 122.217 -0.302 . . . . 0.0 110.755 -178.962 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 36' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -67.32 -42.29 83.86 Favored 'General case' 0 N--CA 1.462 0.147 0 C-N-CA 124.264 1.026 . . . . 0.0 108.242 178.697 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 37' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -74.51 -21.57 59.48 Favored 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 124.356 1.063 . . . . 0.0 110.675 178.781 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 85.56 -5.93 81.91 Favored Glycine 0 CA--C 1.537 1.428 0 N-CA-C 109.71 -1.356 . . . . 0.0 109.71 -177.688 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 39' ' ' LEU . . . . . . . . . . . . . 84.4 mt -89.01 110.27 20.99 Favored 'General case' 0 N--CA 1.445 -0.687 0 C-N-CA 128.144 2.578 . . . . 0.0 105.68 179.312 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 40' ' ' THR . . . . . . . . . . . . . 5.0 t -48.04 155.2 0.47 Allowed 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 123.777 0.831 . . . . 0.0 109.589 178.184 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 41' ' ' VAL . . . . . . . . . . . . . 52.9 t -45.65 -43.2 3.95 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.505 0 C-N-CA 124.479 1.112 . . . . 0.0 111.441 -179.392 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 42' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -64.26 -35.64 81.49 Favored 'General case' 0 CA--C 1.542 0.638 0 O-C-N 121.487 -0.758 . . . . 0.0 112.93 179.823 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -76.25 -44.51 37.09 Favored 'General case' 0 C--O 1.226 -0.162 0 C-N-CA 126.277 1.831 . . . . 0.0 108.957 178.579 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 44' ' ' TYR . . . . . . . . . . . . . 64.0 t80 -55.69 -51.93 65.59 Favored 'General case' 0 N--CA 1.446 -0.659 0 C-N-CA 124.812 1.245 . . . . 0.0 109.256 179.5 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 45' ' ' ILE . . . . . . . . . . . . . 21.6 mm -54.96 -60.43 1.6 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.395 0 C-N-CA 123.86 0.864 . . . . 0.0 111.739 179.653 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 46' ' ' ARG . . . . . . . . . . . . . 3.3 ptm180 -53.91 -45.58 71.21 Favored 'General case' 0 C--O 1.224 -0.246 0 CA-C-O 118.429 -0.796 . . . . 0.0 111.368 -179.508 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 47' ' ' ASN . . . . . . . . . . . . . 27.4 t30 -62.24 -57.02 12.96 Favored 'General case' 0 N--CA 1.452 -0.343 0 C-N-CA 124.939 1.296 . . . . 0.0 110.878 -179.473 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -58.13 -30.58 66.44 Favored 'General case' 0 C--N 1.334 -0.093 0 C-N-CA 123.891 0.876 . . . . 0.0 113.264 -178.725 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 49' ' ' ALA . . . . . . . . . . . . . . . -82.58 -29.35 30.31 Favored 'General case' 0 N--CA 1.451 -0.41 0 N-CA-C 114.274 1.213 . . . . 0.0 114.274 -179.208 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 43.7 mt -84.88 -37.6 20.43 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-N 119.084 0.856 . . . . 0.0 111.171 -179.234 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 51' ' ' ASN . . . . . . . . . . . . . 63.5 m-20 . . . . . 0 C--O 1.251 1.149 0 CA-C-O 116.576 -1.678 . . . . 0.0 110.324 179.33 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 4.1 t . . . . . 0 N--CA 1.437 -1.097 0 CA-C-O 122.161 0.981 . . . . 0.0 108.355 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 24.7 t -109.71 147.03 14.39 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.763 0 N-CA-C 104.437 -2.431 . . . . 0.0 104.437 176.665 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 11.3 p -143.44 105.45 1.01 Allowed 'Isoleucine or valine' 0 N--CA 1.445 -0.709 0 N-CA-C 104.431 -2.433 . . . . 0.0 104.431 178.198 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 49.5 ttm-85 -148.34 156.02 42.0 Favored 'General case' 0 C--N 1.325 -0.462 0 C-N-CA 123.245 0.618 . . . . 0.0 109.743 -179.344 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 23.4 m -103.62 129.7 50.94 Favored 'General case' 0 N--CA 1.451 -0.402 0 N-CA-C 104.07 -2.567 . . . . 0.0 104.07 178.445 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -135.98 111.66 9.36 Favored 'General case' 0 N--CA 1.453 -0.322 0 N-CA-C 108.163 -1.051 . . . . 0.0 108.163 -178.413 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 89.4 mtm-85 -86.06 138.93 31.58 Favored 'General case' 0 N--CA 1.462 0.168 0 CA-C-O 117.369 -1.3 . . . . 0.0 112.345 -178.805 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 32.2 m-85 -123.0 159.39 28.47 Favored 'General case' 0 N--CA 1.481 1.112 0 C-N-CA 127.12 2.168 . . . . 0.0 110.195 -178.62 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . 0.401 ' HB3' ' HD2' ' A' ' 24' ' ' PRO . 1.9 m -80.75 167.72 30.48 Favored Pre-proline 0 CA--C 1.541 0.614 0 CA-C-N 119.097 0.862 . . . . 0.0 109.691 179.7 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . 0.401 ' HD2' ' HB3' ' A' ' 23' ' ' SER . 41.8 Cg_endo -65.25 -42.17 14.19 Favored 'Trans proline' 0 N--CA 1.459 -0.535 0 C-N-CA 121.929 1.752 . . . . 0.0 112.373 -179.653 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 77.1 t -58.39 -53.07 51.47 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.315 0 N-CA-C 108.075 -1.083 . . . . 0.0 108.075 179.757 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 -56.84 -46.03 81.98 Favored 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 124.451 1.1 . . . . 0.0 110.863 179.453 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 19.3 t70 -60.24 -50.1 75.01 Favored 'General case' 0 CA--C 1.512 -0.511 0 C-N-CA 124.072 0.949 . . . . 0.0 112.549 -179.618 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -60.24 -43.61 95.93 Favored 'General case' 0 N--CA 1.452 -0.338 0 N-CA-C 109.645 -0.502 . . . . 0.0 109.645 -179.783 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 63.1 m -58.71 -54.42 47.29 Favored 'General case' 0 N--CA 1.451 -0.385 0 N-CA-C 109.293 -0.632 . . . . 0.0 109.293 179.448 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 78.3 mt -58.14 -45.58 88.56 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.362 0 C-N-CA 123.008 0.523 . . . . 0.0 109.727 -179.673 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 29.1 ttt180 -61.65 -43.61 98.53 Favored 'General case' 0 C--N 1.334 -0.076 0 O-C-N 121.358 -0.839 . . . . 0.0 112.225 -178.941 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -68.81 -47.69 65.46 Favored 'General case' 0 CA--C 1.528 0.127 0 CA-C-N 118.915 0.78 . . . . 0.0 109.922 -179.7 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 71.8 mmtt -63.93 -46.42 84.82 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-N 118.819 0.736 . . . . 0.0 112.098 -178.885 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -60.01 -52.48 65.19 Favored 'General case' 0 N--CA 1.448 -0.549 0 C-N-CA 122.53 0.332 . . . . 0.0 110.614 -179.482 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 26.9 tp10 -62.8 -37.35 86.37 Favored 'General case' 0 N--CA 1.454 -0.263 0 CA-C-N 116.594 -0.276 . . . . 0.0 111.4 -178.646 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -63.79 -38.89 92.79 Favored 'General case' 0 CA--C 1.527 0.059 0 N-CA-C 108.685 -0.857 . . . . 0.0 108.685 179.282 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 33.1 t -75.19 -10.45 59.48 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 123.76 0.824 . . . . 0.0 110.725 178.69 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 77.77 4.02 84.7 Favored Glycine 0 CA--C 1.528 0.861 0 O-C-N 120.791 -1.193 . . . . 0.0 113.246 179.365 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 1.8 mt -118.66 115.86 25.39 Favored 'General case' 0 CA--C 1.508 -0.656 0 N-CA-C 102.685 -3.08 . . . . 0.0 102.685 179.448 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 3.1 t -46.72 160.54 0.08 Allowed 'General case' 0 C--N 1.323 -0.552 0 C-N-CA 125.615 1.566 . . . . 0.0 112.499 -179.031 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 9.2 m -47.06 -38.39 4.36 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.591 0 N-CA-C 114.13 1.159 . . . . 0.0 114.13 -177.72 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . 0.44 ' HA ' HD11 ' B' ' 20' ' ' LEU . 6.9 p -66.05 -52.2 51.24 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-N 119.485 1.039 . . . . 0.0 109.898 179.153 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -56.88 -43.44 81.27 Favored 'General case' 0 CA--C 1.531 0.223 0 C-N-CA 124.185 0.994 . . . . 0.0 109.356 178.185 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 83.3 t80 -58.51 -52.28 66.32 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 124.04 0.936 . . . . 0.0 108.952 178.794 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 2.4 mm -53.39 -63.8 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.343 0.308 0 C-N-CA 126.176 1.79 . . . . 0.0 110.011 179.76 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 2.4 ptm180 -56.13 -43.02 77.8 Favored 'General case' 0 CA--C 1.516 -0.347 0 CA-C-O 117.675 -1.155 . . . . 0.0 111.637 -178.693 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 9.3 t30 -61.3 -54.71 40.51 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 119.459 1.027 . . . . 0.0 110.49 179.368 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -60.16 -32.92 71.5 Favored 'General case' 0 C--O 1.224 -0.282 0 C-N-CA 123.479 0.712 . . . . 0.0 112.157 -179.17 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -71.39 -27.04 63.04 Favored 'General case' 0 CA--C 1.535 0.382 0 N-CA-C 112.975 0.732 . . . . 0.0 112.975 -179.663 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 19.4 mt -92.48 -35.66 13.51 Favored 'General case' 0 CA--C 1.518 -0.267 0 C-N-CA 123.413 0.685 . . . . 0.0 109.81 -179.758 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 78.4 m-20 . . . . . 0 C--O 1.251 1.133 0 C-N-CA 125.334 1.454 . . . . 0.0 109.669 -180.0 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 6.4 t . . . . . 0 N--CA 1.44 -0.967 0 CA-C-O 123.237 1.494 . . . . 0.0 109.885 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 36.4 t -102.42 146.53 10.31 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.873 0 N-CA-C 101.964 -3.347 . . . . 0.0 101.964 175.004 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 9.5 p -148.14 100.0 0.37 Allowed 'Isoleucine or valine' 0 N--CA 1.442 -0.861 0 N-CA-C 102.51 -3.144 . . . . 0.0 102.51 177.254 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 46.3 ttm-85 -142.34 160.51 40.11 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.057 -0.974 . . . . 0.0 109.282 -178.77 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -108.85 122.64 47.62 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 101.278 -3.601 . . . . 0.0 101.278 178.396 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 20' ' ' LEU . . . . . 0.44 HD11 ' HA ' ' A' ' 42' ' ' SER . 7.5 tt -134.44 112.62 11.08 Favored 'General case' 0 N--CA 1.463 0.208 0 C-N-CA 124.609 1.163 . . . . 0.0 109.199 -177.02 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 75.1 mtm-85 -78.98 162.45 25.95 Favored 'General case' 0 N--CA 1.47 0.562 0 N-CA-C 113.52 0.933 . . . . 0.0 113.52 -178.763 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 22' ' ' PHE . . . . . . . . . . . . . 45.4 m-85 -143.05 160.75 39.78 Favored 'General case' 0 N--CA 1.47 0.549 0 C-N-CA 127.117 2.167 . . . . 0.0 107.388 179.361 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 23' ' ' SER . . . . . 0.473 ' HB3' ' HD2' ' B' ' 24' ' ' PRO . 3.1 m -88.97 173.91 5.57 Favored Pre-proline 0 CA--C 1.545 0.756 0 C-N-CA 124.692 1.197 . . . . 0.0 109.899 179.823 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 24' ' ' PRO . . . . . 0.473 ' HD2' ' HB3' ' B' ' 23' ' ' SER . 55.7 Cg_endo -68.1 -47.47 1.72 Allowed 'Trans proline' 0 C--N 1.352 0.757 0 C-N-CA 121.687 1.591 . . . . 0.0 112.17 -178.543 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 25' ' ' VAL . . . . . . . . . . . . . 33.8 t -67.51 -31.23 51.76 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.388 0 C-N-CA 123.913 0.885 . . . . 0.0 110.296 -179.583 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 58.1 mt-10 -70.08 -48.7 56.66 Favored 'General case' 0 CA--C 1.529 0.137 0 N-CA-C 108.012 -1.107 . . . . 0.0 108.012 179.409 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 27' ' ' ASP . . . . . . . . . . . . . 23.8 t70 -60.38 -43.67 96.37 Favored 'General case' 0 C--O 1.219 -0.545 0 C-N-CA 124.968 1.307 . . . . 0.0 110.717 179.37 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 28' ' ' GLU . . . . . . . . . . . . . 12.9 tt0 -56.43 -52.2 65.54 Favored 'General case' 0 N--CA 1.454 -0.254 0 C-N-CA 124.768 1.227 . . . . 0.0 110.146 -179.696 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 4.1 m -56.71 -55.48 33.62 Favored 'General case' 0 CA--C 1.53 0.199 0 N-CA-C 109.118 -0.697 . . . . 0.0 109.118 178.96 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 73.2 mt -54.12 -50.92 51.58 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.202 0 C-N-CA 123.279 0.631 . . . . 0.0 110.845 -178.986 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 58.9 ttt180 -56.89 -48.31 78.47 Favored 'General case' 0 N--CA 1.449 -0.507 0 C-N-CA 124.587 1.155 . . . . 0.0 111.331 -178.952 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 1.9 mptm? -65.65 -45.98 80.93 Favored 'General case' 0 CA--C 1.515 -0.398 0 O-C-N 123.909 0.756 . . . . 0.0 110.379 -179.519 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 34.9 mmtt -62.47 -44.6 96.0 Favored 'General case' 0 C--N 1.333 -0.117 0 CA-C-N 119.455 1.025 . . . . 0.0 110.239 -179.02 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 34' ' ' ALA . . . . . . . . . . . . . . . -58.2 -54.61 45.05 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 124.866 1.267 . . . . 0.0 110.024 179.192 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 7.4 tp10 -66.57 -16.78 64.41 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 124.635 1.174 . . . . 0.0 112.775 -179.055 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 36' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -102.05 4.61 39.95 Favored 'General case' 0 C--N 1.327 -0.409 0 C-N-CA 126.015 1.726 . . . . 0.0 111.466 -179.899 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 37' ' ' SER . . . . . . . . . . . . . 9.1 t -127.59 -1.27 6.15 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 124.424 1.09 . . . . 0.0 112.094 179.825 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 67.79 28.72 73.45 Favored Glycine 0 CA--C 1.529 0.936 0 CA-C-N 119.876 1.216 . . . . 0.0 110.64 -178.892 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 39' ' ' LEU . . . . . . . . . . . . . 90.0 mt -120.1 125.24 47.79 Favored 'General case' 0 N--CA 1.444 -0.725 0 C-N-CA 126.041 1.736 . . . . 0.0 106.94 -179.061 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 40' ' ' THR . . . . . 0.543 HG23 ' H ' ' B' ' 43' ' ' ALA . 1.8 t -63.8 153.83 35.33 Favored 'General case' 0 CA--C 1.538 0.502 0 N-CA-C 104.703 -2.332 . . . . 0.0 104.703 176.8 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 41' ' ' VAL . . . . . . . . . . . . . 55.1 t -48.64 -38.75 10.01 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.498 0 O-C-N 121.392 -0.818 . . . . 0.0 110.261 179.071 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 42' ' ' SER . . . . . . . . . . . . . 14.4 m -62.39 -46.55 88.09 Favored 'General case' 0 CA--C 1.533 0.324 0 O-C-N 121.057 -1.027 . . . . 0.0 111.368 179.085 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 43' ' ' ALA . . . . . 0.543 ' H ' HG23 ' B' ' 40' ' ' THR . . . -64.9 -40.91 95.83 Favored 'General case' 0 C--N 1.34 0.164 0 C-N-CA 123.913 0.885 . . . . 0.0 109.23 178.803 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 44' ' ' TYR . . . . . . . . . . . . . 57.3 t80 -58.45 -50.92 71.99 Favored 'General case' 0 CA--C 1.539 0.54 0 N-CA-C 108.276 -1.009 . . . . 0.0 108.276 179.106 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 45' ' ' ILE . . . . . . . . . . . . . 12.9 mm -56.74 -61.32 1.26 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.301 0 C-N-CA 125.122 1.369 . . . . 0.0 108.609 178.807 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 46' ' ' ARG . . . . . . . . . . . . . 40.2 mtp180 -43.9 -66.01 0.43 Allowed 'General case' 0 C--O 1.219 -0.51 0 C-N-CA 126.044 1.738 . . . . 0.0 110.588 179.781 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 47' ' ' ASN . . . . . . . . . . . . . 20.5 t30 -53.25 -49.54 66.67 Favored 'General case' 0 N--CA 1.441 -0.88 0 C-N-CA 124.719 1.208 . . . . 0.0 113.601 -178.04 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -63.18 -31.62 72.81 Favored 'General case' 0 CA--C 1.535 0.399 0 CA-C-N 118.99 0.814 . . . . 0.0 111.264 179.514 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 49' ' ' ALA . . . . . . . . . . . . . . . -78.68 -16.09 57.7 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 124.067 0.947 . . . . 0.0 113.512 -179.712 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 13.9 mt -100.32 -38.02 8.63 Favored 'General case' 0 C--O 1.234 0.283 0 O-C-N 121.451 -0.781 . . . . 0.0 109.981 179.886 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 51' ' ' ASN . . . . . . . . . . . . . 43.2 m-80 . . . . . 0 C--O 1.246 0.907 0 C-N-CA 124.502 1.121 . . . . 0.0 110.136 179.155 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 12.2 t . . . . . 0 N--CA 1.436 -1.159 0 CA-C-O 124.107 1.908 . . . . 0.0 110.89 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 16.1 t -122.92 144.19 33.26 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.961 1 N-CA-C 100.072 -4.047 . . . . 0.0 100.072 176.51 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 13.1 p -136.9 102.08 2.57 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.021 0 N-CA-C 104.244 -2.502 . . . . 0.0 104.244 179.234 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 6.0 mtt-85 -128.25 158.96 36.7 Favored 'General case' 0 CA--C 1.509 -0.603 0 CA-C-O 123.103 1.43 . . . . 0.0 109.792 -179.969 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 3.7 m -94.2 83.21 4.21 Favored 'General case' 0 N--CA 1.439 -1.003 0 N-CA-C 104.049 -2.574 . . . . 0.0 104.049 -179.234 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -84.17 92.67 7.98 Favored 'General case' 0 C--N 1.325 -0.458 0 C-N-CA 124.294 1.037 . . . . 0.0 111.058 -177.771 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -74.2 146.48 43.34 Favored 'General case' 0 N--CA 1.447 -0.596 0 C-N-CA 123.961 0.904 . . . . 0.0 112.666 179.204 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 90.5 m-85 -137.11 152.29 49.83 Favored 'General case' 0 C--O 1.238 0.458 0 C-N-CA 126.624 1.97 . . . . 0.0 106.088 177.274 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 1.2 m -86.52 167.68 21.82 Favored Pre-proline 0 CA--C 1.543 0.692 0 N-CA-C 106.59 -1.633 . . . . 0.0 106.59 179.438 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -66.76 -30.84 40.73 Favored 'Trans proline' 0 CA--C 1.531 0.368 0 CA-C-N 121.201 1.465 . . . . 0.0 111.428 -179.355 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 44.8 t -69.32 -45.29 79.35 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.322 0 N-CA-C 108.456 -0.942 . . . . 0.0 108.456 179.308 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -64.37 -46.24 84.26 Favored 'General case' 0 C--O 1.224 -0.276 0 N-CA-C 109.52 -0.548 . . . . 0.0 109.52 -179.789 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -58.35 -44.21 88.66 Favored 'General case' 0 CA--C 1.513 -0.458 0 C-N-CA 123.874 0.87 . . . . 0.0 111.233 -179.772 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 15.3 tm-20 -62.24 -51.39 67.95 Favored 'General case' 0 N--CA 1.448 -0.565 0 N-CA-C 109.166 -0.679 . . . . 0.0 109.166 179.856 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 88.9 m -59.38 -53.41 58.56 Favored 'General case' 0 CA--C 1.534 0.34 0 CA-C-N 118.353 0.524 . . . . 0.0 110.009 179.482 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 83.9 mt -57.97 -43.53 85.0 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.293 0 C-N-CA 124.193 0.997 . . . . 0.0 109.861 -179.283 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 40.8 ttt180 -62.94 -42.23 99.74 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-N 119.296 0.953 . . . . 0.0 110.16 -179.63 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 4.7 mptp? -68.98 -47.71 64.91 Favored 'General case' 0 CA--C 1.515 -0.38 0 CA-C-O 118.843 -0.598 . . . . 0.0 109.864 -179.554 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 21.3 tptt -63.01 -41.1 99.48 Favored 'General case' 0 C--O 1.224 -0.27 0 CA-C-O 119.005 -0.521 . . . . 0.0 110.536 -179.488 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -61.08 -53.45 57.0 Favored 'General case' 0 N--CA 1.453 -0.294 0 C-N-CA 124.841 1.257 . . . . 0.0 109.236 179.071 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 30.5 tt0 -57.84 -44.23 86.38 Favored 'General case' 0 N--CA 1.453 -0.303 0 C-N-CA 122.966 0.507 . . . . 0.0 111.17 -179.299 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 27.0 t0 -67.33 -39.61 85.86 Favored 'General case' 0 C--N 1.332 -0.156 0 C-N-CA 123.378 0.671 . . . . 0.0 109.9 -179.85 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 22.9 t -72.3 -9.17 58.14 Favored 'General case' 0 N--CA 1.451 -0.403 0 C-N-CA 124.53 1.132 . . . . 0.0 111.007 179.66 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 65.49 29.76 75.95 Favored Glycine 0 CA--C 1.53 1.012 0 CA-C-N 119.391 0.996 . . . . 0.0 111.683 -179.682 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 71.6 mt -133.42 115.65 15.09 Favored 'General case' 0 N--CA 1.451 -0.42 0 N-CA-C 103.797 -2.668 . . . . 0.0 103.797 179.703 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 14.8 t -57.13 161.65 3.01 Favored 'General case' 0 CA--C 1.535 0.391 0 CA-C-N 119.276 0.944 . . . . 0.0 110.19 -179.843 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 97.7 t -44.19 -45.77 2.24 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.213 0 C-N-CA 126.118 1.767 . . . . 0.0 111.555 -178.812 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 2.5 p -64.19 -47.49 79.58 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-N 120.304 1.411 . . . . 0.0 112.076 -179.806 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -62.1 -44.28 97.0 Favored 'General case' 0 C--O 1.222 -0.353 0 C-N-CA 124.412 1.085 . . . . 0.0 109.176 178.69 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 61.2 t80 -59.27 -51.07 71.55 Favored 'General case' 0 N--CA 1.453 -0.322 0 C-N-CA 125.403 1.481 . . . . 0.0 108.798 179.073 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.411 HG23 HG23 ' B' ' 45' ' ' ILE . 13.8 mm -55.19 -60.32 1.73 Allowed 'Isoleucine or valine' 0 C--O 1.226 -0.132 0 C-N-CA 124.408 1.083 . . . . 0.0 110.163 179.705 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 21.2 ptt180 -59.93 -44.64 94.21 Favored 'General case' 0 C--O 1.219 -0.524 0 CA-C-O 118.366 -0.826 . . . . 0.0 110.499 -179.2 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 18.0 t30 -53.57 -56.73 14.6 Favored 'General case' 0 CA--C 1.519 -0.215 0 CA-C-N 119.374 0.988 . . . . 0.0 110.079 179.875 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -61.42 -33.13 73.19 Favored 'General case' 0 N--CA 1.453 -0.284 0 C-N-CA 124.174 0.99 . . . . 0.0 112.245 -179.81 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -75.5 -24.42 56.85 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 123.441 0.696 . . . . 0.0 112.874 -179.588 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 11.8 mt -98.55 -29.19 13.22 Favored 'General case' 0 N--CA 1.465 0.298 0 C-N-CA 123.583 0.753 . . . . 0.0 111.325 -179.399 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 43.3 m-80 . . . . . 0 C--O 1.243 0.75 0 C-N-CA 126.655 1.982 . . . . 0.0 108.378 -179.846 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 4.5 t . . . . . 0 N--CA 1.442 -0.841 0 N-CA-C 108.852 -0.796 . . . . 0.0 108.852 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 21.4 t -105.56 120.28 56.1 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.53 0 N-CA-C 104.58 -2.378 . . . . 0.0 104.58 178.674 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 9.4 p -115.59 90.7 1.58 Allowed 'Isoleucine or valine' 0 N--CA 1.447 -0.6 0 N-CA-C 106.233 -1.766 . . . . 0.0 106.233 178.717 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -117.77 161.64 19.37 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 114.234 -1.348 . . . . 0.0 109.185 -179.857 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 56.3 m -104.99 88.68 2.93 Favored 'General case' 0 N--CA 1.448 -0.526 0 N-CA-C 105.155 -2.165 . . . . 0.0 105.155 -179.654 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -90.7 105.6 17.94 Favored 'General case' 0 C--N 1.324 -0.514 0 C-N-CA 125.612 1.565 . . . . 0.0 110.894 -178.47 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 1.4 mpp_? -82.55 154.07 25.21 Favored 'General case' 0 N--CA 1.455 -0.216 0 C-N-CA 123.548 0.739 . . . . 0.0 111.555 178.847 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 22' ' ' PHE . . . . . . . . . . . . . 81.7 m-85 -138.35 141.69 39.7 Favored 'General case' 0 CA--C 1.516 -0.342 0 N-CA-C 106.624 -1.621 . . . . 0.0 106.624 178.129 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 14.5 m -71.61 165.76 46.12 Favored Pre-proline 0 CA--C 1.539 0.556 0 N-CA-C 109.318 -0.623 . . . . 0.0 109.318 179.653 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 24' ' ' PRO . . . . . . . . . . . . . 33.9 Cg_endo -62.36 -38.52 53.04 Favored 'Trans proline' 0 C--N 1.348 0.529 0 C-N-CA 121.457 1.438 . . . . 0.0 111.145 -179.4 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 25' ' ' VAL . . . . . . . . . . . . . 60.5 t -65.42 -49.39 78.71 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.254 0 C-N-CA 124.433 1.093 . . . . 0.0 109.346 179.41 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 54.8 mt-10 -58.96 -49.33 78.26 Favored 'General case' 0 C--O 1.223 -0.335 0 C-N-CA 124.097 0.959 . . . . 0.0 109.743 -179.716 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 27' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -59.83 -39.04 83.73 Favored 'General case' 0 N--CA 1.453 -0.306 0 C-N-CA 124.753 1.221 . . . . 0.0 111.771 -179.832 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 28' ' ' GLU . . . . . . . . . . . . . 12.4 tt0 -66.61 -53.33 35.44 Favored 'General case' 0 N--CA 1.453 -0.315 0 N-CA-C 109.231 -0.655 . . . . 0.0 109.231 179.551 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 64.8 m -57.63 -50.58 72.67 Favored 'General case' 0 N--CA 1.454 -0.251 0 C-N-CA 124.064 0.945 . . . . 0.0 110.02 179.438 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 81.3 mt -60.78 -42.93 94.12 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.354 0 C-N-CA 123.564 0.746 . . . . 0.0 109.275 -179.676 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 56.8 ttt180 -61.42 -51.01 70.52 Favored 'General case' 0 CA--C 1.519 -0.213 0 CA-C-N 119.296 0.953 . . . . 0.0 110.211 179.261 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 5.0 mptp? -60.77 -44.16 97.11 Favored 'General case' 0 CA--C 1.52 -0.195 0 CA-C-N 118.371 0.532 . . . . 0.0 110.388 -179.293 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 34.4 tptt -68.81 -38.99 80.29 Favored 'General case' 0 CA--C 1.528 0.129 0 CA-C-N 118.865 0.757 . . . . 0.0 111.088 -179.631 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 34' ' ' ALA . . . . . . . . . . . . . . . -65.81 -36.25 82.97 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-O 122.577 1.18 . . . . 0.0 109.348 178.825 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 20.6 tt0 -75.7 -19.39 59.14 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 124.137 0.975 . . . . 0.0 110.294 179.433 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 36' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -86.19 -45.55 11.22 Favored 'General case' 0 C--O 1.232 0.169 0 C-N-CA 125.561 1.544 . . . . 0.0 109.856 179.109 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 37' ' ' SER . . . . . . . . . . . . . 48.0 t -79.16 -10.96 59.96 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-O 118.787 -0.625 . . . . 0.0 109.914 -179.911 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 82.39 -7.69 63.75 Favored Glycine 0 C--N 1.338 0.685 0 C-N-CA 124.975 1.274 . . . . 0.0 115.165 178.227 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 39' ' ' LEU . . . . . . . . . . . . . 13.8 mt -96.44 125.48 40.96 Favored 'General case' 0 CA--C 1.518 -0.253 0 CA-C-N 120.235 2.017 . . . . 0.0 105.85 -179.519 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 40' ' ' THR . . . . . . . . . . . . . 5.3 t -45.85 151.32 0.46 Allowed 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 125.202 1.401 . . . . 0.0 110.497 179.851 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 41' ' ' VAL . . . . . . . . . . . . . 53.3 t -45.73 -46.41 4.93 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.218 0 C-N-CA 125.307 1.443 . . . . 0.0 111.772 -179.047 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 42' ' ' SER . . . . . . . . . . . . . 9.6 p -55.55 -45.38 77.27 Favored 'General case' 0 C--O 1.235 0.291 0 O-C-N 121.747 -0.596 . . . . 0.0 112.188 -179.967 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -70.23 -46.74 63.86 Favored 'General case' 0 C--O 1.222 -0.391 0 C-N-CA 124.582 1.153 . . . . 0.0 108.854 178.936 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 44' ' ' TYR . . . . . . . . . . . . . 38.8 t80 -49.61 -50.58 42.23 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 124.626 1.17 . . . . 0.0 109.08 179.662 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 45' ' ' ILE . . . . . 0.411 HG23 HG23 ' A' ' 45' ' ' ILE . 21.6 mm -54.44 -61.19 1.04 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.421 0 C-N-CA 124.085 0.954 . . . . 0.0 111.395 179.457 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 46' ' ' ARG . . . . . . . . . . . . . 12.1 ptm180 -59.91 -43.97 94.56 Favored 'General case' 0 N--CA 1.467 0.396 0 O-C-N 121.736 -0.602 . . . . 0.0 111.704 -178.766 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 47' ' ' ASN . . . . . . . . . . . . . 20.6 t30 -56.95 -57.16 13.73 Favored 'General case' 0 N--CA 1.449 -0.509 0 C-N-CA 124.392 1.077 . . . . 0.0 110.76 -179.113 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -61.95 -33.41 74.23 Favored 'General case' 0 N--CA 1.453 -0.281 0 C-N-CA 124.404 1.081 . . . . 0.0 111.708 -179.968 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 49' ' ' ALA . . . . . . . . . . . . . . . -68.56 -42.24 78.64 Favored 'General case' 0 N--CA 1.451 -0.376 0 O-C-N 121.703 -0.623 . . . . 0.0 112.114 -179.11 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 12.5 mt -80.46 -36.03 34.08 Favored 'General case' 0 C--N 1.328 -0.362 0 C-N-CA 123.115 0.566 . . . . 0.0 112.061 -178.844 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 51' ' ' ASN . . . . . . . . . . . . . 46.7 m-80 . . . . . 0 C--O 1.248 1.0 0 CA-C-O 117.362 -1.304 . . . . 0.0 109.769 -179.077 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 14.6 t . . . . . 0 N--CA 1.446 -0.674 0 N-CA-C 107.048 -1.464 . . . . 0.0 107.048 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 36.2 t -119.56 129.31 75.49 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.672 0 N-CA-C 104.108 -2.553 . . . . 0.0 104.108 178.92 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 14.3 p -122.0 98.97 6.35 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.515 0 N-CA-C 102.842 -3.021 . . . . 0.0 102.842 178.202 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 62.4 mtt-85 -140.42 164.9 28.88 Favored 'General case' 0 CA--C 1.51 -0.565 0 CA-C-N 115.021 -0.99 . . . . 0.0 110.119 -179.279 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -110.39 148.76 31.37 Favored 'General case' 0 N--CA 1.444 -0.73 0 C-N-CA 125.216 1.406 . . . . 0.0 107.615 179.272 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 58.2 mt -145.09 112.87 6.33 Favored 'General case' 0 CA--C 1.51 -0.558 0 N-CA-C 107.228 -1.397 . . . . 0.0 107.228 178.749 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 14.8 mtm180 -86.42 152.17 22.92 Favored 'General case' 0 C--O 1.238 0.492 0 N-CA-C 107.416 -1.327 . . . . 0.0 107.416 178.052 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 87.7 m-85 -132.8 140.08 47.83 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 105.415 -2.069 . . . . 0.0 105.415 179.58 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -66.76 173.15 2.66 Favored Pre-proline 0 CA--C 1.552 1.037 0 CA-C-N 119.324 0.965 . . . . 0.0 109.53 -179.841 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 28.9 Cg_endo -63.44 -42.29 22.42 Favored 'Trans proline' 0 C--N 1.348 0.517 0 C-N-CA 121.845 1.697 . . . . 0.0 112.983 -178.029 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 38.4 t -67.11 -40.05 84.51 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.306 0 C-N-CA 123.613 0.765 . . . . 0.0 109.653 -179.995 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 -66.26 -44.18 84.35 Favored 'General case' 0 CA--C 1.521 -0.171 0 C-N-CA 124.94 1.296 . . . . 0.0 111.089 -178.791 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 34.5 t70 -61.88 -49.11 77.54 Favored 'General case' 0 CA--C 1.502 -0.89 0 N-CA-C 108.289 -1.004 . . . . 0.0 108.289 179.22 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 44.8 tt0 -52.52 -43.77 65.33 Favored 'General case' 0 N--CA 1.445 -0.714 0 CA-C-O 118.325 -0.845 . . . . 0.0 110.941 179.945 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 32.4 m -65.92 -54.92 20.15 Favored 'General case' 0 CA--C 1.529 0.154 0 CA-C-N 118.837 0.744 . . . . 0.0 109.631 179.185 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 79.9 mt -63.11 -25.6 38.92 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.325 0 CA-C-O 121.724 0.773 . . . . 0.0 111.784 -178.661 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 42.2 ttt180 -77.84 -45.46 24.26 Favored 'General case' 0 C--N 1.316 -0.882 0 O-C-N 119.826 -1.796 . . . . 0.0 107.582 179.526 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 5.6 mptt -68.47 -47.28 67.53 Favored 'General case' 0 CA--C 1.519 -0.22 0 CA-C-O 118.167 -0.92 . . . . 0.0 112.78 179.879 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 29.3 tptt -67.97 -33.67 75.09 Favored 'General case' 0 CA--C 1.523 -0.081 0 CA-C-N 120.407 1.458 . . . . 0.0 111.746 -177.941 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -67.13 -54.88 17.17 Favored 'General case' 0 C--N 1.331 -0.207 0 C-N-CA 125.249 1.42 . . . . 0.0 108.212 179.599 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 22.7 tt0 -60.13 -39.99 88.22 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-N 115.48 -0.782 . . . . 0.0 111.213 -179.143 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -64.95 -41.25 95.66 Favored 'General case' 0 N--CA 1.462 0.126 0 C-N-CA 124.857 1.263 . . . . 0.0 109.984 179.111 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 35.7 m -79.57 -9.05 59.56 Favored 'General case' 0 N--CA 1.448 -0.574 0 C-N-CA 123.741 0.817 . . . . 0.0 112.706 -179.388 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 75.15 13.56 82.63 Favored Glycine 0 CA--C 1.531 1.045 0 CA-C-N 119.377 0.99 . . . . 0.0 113.508 -179.972 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 13.0 mt -115.77 116.43 28.03 Favored 'General case' 0 CA--C 1.511 -0.549 0 N-CA-C 104.379 -2.452 . . . . 0.0 104.379 179.047 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 9.9 t -53.47 157.39 2.11 Favored 'General case' 0 CA--C 1.537 0.449 0 N-CA-C 109.486 -0.561 . . . . 0.0 109.486 179.062 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 61.0 t -45.62 -43.86 4.08 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.206 0 C-N-CA 125.223 1.409 . . . . 0.0 111.551 -179.457 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 97.7 p -59.68 -50.36 74.16 Favored 'General case' 0 CA--C 1.545 0.752 0 CA-C-N 119.44 1.018 . . . . 0.0 111.206 -179.42 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.5 -42.55 98.5 Favored 'General case' 0 C--N 1.339 0.126 0 C-N-CA 124.302 1.041 . . . . 0.0 109.743 179.161 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 67.9 t80 -57.46 -53.33 59.42 Favored 'General case' 0 N--CA 1.45 -0.467 0 N-CA-C 109.335 -0.617 . . . . 0.0 109.335 179.211 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 23.3 mm -54.13 -54.83 17.84 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.152 0 C-N-CA 124.269 1.027 . . . . 0.0 111.372 -179.292 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 13.2 ptt180 -60.78 -50.84 71.83 Favored 'General case' 0 N--CA 1.464 0.266 0 O-C-N 121.609 -0.682 . . . . 0.0 111.397 -179.615 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 22.9 t30 -55.41 -58.37 8.04 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 118.667 -0.682 . . . . 0.0 110.463 -179.562 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -57.14 -31.97 65.89 Favored 'General case' 0 N--CA 1.456 -0.138 0 C-N-CA 124.106 0.963 . . . . 0.0 113.297 -178.934 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -79.81 -33.21 40.61 Favored 'General case' 0 CA--C 1.531 0.248 0 N-CA-C 114.396 1.258 . . . . 0.0 114.396 -179.18 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 13.8 mt -82.98 -33.42 26.62 Favored 'General case' 0 N--CA 1.47 0.53 0 CA-C-N 118.5 0.591 . . . . 0.0 111.316 -178.988 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 3.4 m-80 . . . . . 0 C--O 1.249 1.028 0 C-N-CA 124.646 1.179 . . . . 0.0 108.335 179.107 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 12.4 t . . . . . 0 N--CA 1.441 -0.883 0 N-CA-C 107.35 -1.352 . . . . 0.0 107.35 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 21.1 t -138.11 152.85 26.32 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.516 0 N-CA-C 106.762 -1.57 . . . . 0.0 106.762 -179.905 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 9.8 p -141.62 104.19 1.3 Allowed 'Isoleucine or valine' 0 N--CA 1.441 -0.891 0 N-CA-C 104.46 -2.422 . . . . 0.0 104.46 177.795 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 30.2 mtt-85 -149.66 152.98 36.28 Favored 'General case' 0 CA--C 1.517 -0.31 0 O-C-N 121.708 -0.62 . . . . 0.0 110.636 -179.323 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 2.3 m -100.36 145.13 28.54 Favored 'General case' 0 C--N 1.327 -0.412 0 C-N-CA 124.909 1.283 . . . . 0.0 108.584 -179.515 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 61.3 mt -134.79 112.84 11.05 Favored 'General case' 0 CA--C 1.52 -0.183 0 N-CA-C 107.699 -1.223 . . . . 0.0 107.699 178.871 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 21.8 mmm-85 -82.52 118.16 23.05 Favored 'General case' 0 C--O 1.233 0.234 0 C-N-CA 124.56 1.144 . . . . 0.0 108.747 179.706 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 22' ' ' PHE . . . . . . . . . . . . . 96.7 m-85 -113.55 155.71 24.92 Favored 'General case' 0 N--CA 1.475 0.808 0 CA-C-N 119.725 1.148 . . . . 0.0 108.421 179.427 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -85.91 168.17 20.75 Favored Pre-proline 0 CA--C 1.541 0.619 0 N-CA-C 107.607 -1.257 . . . . 0.0 107.607 179.509 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 24' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_endo -62.77 -33.21 77.08 Favored 'Trans proline' 0 N--CA 1.459 -0.504 0 C-N-CA 121.611 1.54 . . . . 0.0 112.868 -178.835 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 25' ' ' VAL . . . . . . . . . . . . . 26.3 t -68.25 -57.0 10.57 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.187 0 C-N-CA 124.154 0.982 . . . . 0.0 108.907 179.566 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 2.4 mp0 -55.29 -42.5 73.7 Favored 'General case' 0 CA--C 1.529 0.143 0 C-N-CA 123.568 0.747 . . . . 0.0 110.972 -179.703 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 27' ' ' ASP . . . . . . . . . . . . . 5.0 t70 -63.47 -44.66 93.79 Favored 'General case' 0 C--O 1.224 -0.282 0 C-N-CA 123.476 0.71 . . . . 0.0 109.956 178.776 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 28' ' ' GLU . . . . . . . . . . . . . 19.1 tt0 -58.5 -49.06 78.75 Favored 'General case' 0 N--CA 1.45 -0.464 0 N-CA-C 109.285 -0.635 . . . . 0.0 109.285 179.762 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 88.4 m -58.9 -54.68 44.34 Favored 'General case' 0 N--CA 1.452 -0.362 0 C-N-CA 124.835 1.254 . . . . 0.0 109.686 179.816 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 63.8 mt -59.59 -44.98 94.49 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.132 0 CA-C-N 118.302 0.501 . . . . 0.0 110.461 -179.54 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 77.0 ttt180 -59.08 -47.86 83.71 Favored 'General case' 0 C--O 1.235 0.32 0 C-N-CA 123.4 0.68 . . . . 0.0 110.75 -179.14 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 9.2 mptt -62.85 -50.44 70.93 Favored 'General case' 0 CA--C 1.512 -0.494 0 O-C-N 123.812 0.695 . . . . 0.0 109.621 179.27 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 9.1 tptt -62.23 -38.83 90.71 Favored 'General case' 0 CA--C 1.516 -0.349 0 CA-C-O 118.609 -0.71 . . . . 0.0 112.322 -177.858 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 34' ' ' ALA . . . . . . . . . . . . . . . -58.47 -52.73 64.38 Favored 'General case' 0 N--CA 1.45 -0.439 0 N-CA-C 108.251 -1.018 . . . . 0.0 108.251 178.47 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 11.7 tt0 -68.01 -34.98 77.53 Favored 'General case' 0 CA--C 1.533 0.322 0 N-CA-C 113.003 0.742 . . . . 0.0 113.003 -178.853 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 36' ' ' ASP . . . . . . . . . . . . . 30.3 t70 -65.03 -40.78 95.35 Favored 'General case' 0 C--N 1.332 -0.18 0 C-N-CA 125.122 1.369 . . . . 0.0 108.847 179.389 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 37' ' ' SER . . . . . . . . . . . . . 72.4 m -79.77 -12.89 59.76 Favored 'General case' 0 N--CA 1.45 -0.435 0 C-N-CA 123.09 0.556 . . . . 0.0 110.58 178.459 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 79.07 23.55 63.39 Favored Glycine 0 CA--C 1.523 0.589 0 CA-C-O 118.219 -1.323 . . . . 0.0 114.716 179.012 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 39' ' ' LEU . . . . . . . . . . . . . 33.4 mt -122.55 147.49 46.32 Favored 'General case' 0 N--CA 1.455 -0.213 0 CA-C-N 119.898 1.849 . . . . 0.0 106.106 179.225 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 40' ' ' THR . . . . . . . . . . . . . 5.5 t -64.31 152.46 41.08 Favored 'General case' 0 C--N 1.324 -0.509 0 O-C-N 120.959 -1.088 . . . . 0.0 108.251 179.298 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 41' ' ' VAL . . . . . . . . . . . . . 42.0 t -49.94 -44.84 21.84 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.353 0 O-C-N 121.242 -0.911 . . . . 0.0 110.691 179.399 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 42' ' ' SER . . . . . . . . . . . . . 3.7 p -59.74 -35.6 74.91 Favored 'General case' 0 CA--C 1.542 0.645 0 O-C-N 121.178 -0.951 . . . . 0.0 111.776 -179.863 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -75.93 -43.16 46.33 Favored 'General case' 0 C--O 1.22 -0.489 0 C-N-CA 124.186 0.994 . . . . 0.0 108.595 178.465 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 44' ' ' TYR . . . . . . . . . . . . . 56.3 t80 -55.54 -48.02 75.38 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 124.098 0.959 . . . . 0.0 108.744 178.927 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 45' ' ' ILE . . . . . . . . . . . . . 26.0 mm -61.32 -55.9 21.47 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.151 0 C-N-CA 123.718 0.807 . . . . 0.0 111.72 179.747 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 46' ' ' ARG . . . . . . . . . . . . . 21.0 ptt180 -59.13 -44.04 92.02 Favored 'General case' 0 C--O 1.222 -0.348 0 CA-C-N 118.863 0.756 . . . . 0.0 109.764 -179.259 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 47' ' ' ASN . . . . . . . . . . . . . 15.3 t30 -56.51 -59.65 4.68 Favored 'General case' 0 N--CA 1.451 -0.399 0 C-N-CA 124.24 1.016 . . . . 0.0 110.714 179.916 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -58.58 -31.58 68.15 Favored 'General case' 0 CA--C 1.529 0.158 0 N-CA-C 113.456 0.91 . . . . 0.0 113.456 -178.767 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 49' ' ' ALA . . . . . . . . . . . . . . . -78.91 -34.7 44.43 Favored 'General case' 0 N--CA 1.452 -0.357 0 N-CA-C 113.773 1.027 . . . . 0.0 113.773 -179.368 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 30.7 mt -81.23 -35.15 31.6 Favored 'General case' 0 C--N 1.329 -0.316 0 O-C-N 121.59 -0.694 . . . . 0.0 112.408 -178.976 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 51' ' ' ASN . . . . . . . . . . . . . 35.7 m-80 . . . . . 0 C--O 1.252 1.221 0 CA-C-O 115.936 -1.983 . . . . 0.0 114.86 -179.329 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . 0.407 ' HA ' ' O ' ' B' ' 22' ' ' PHE . 2.8 t . . . . . 0 N--CA 1.433 -1.283 0 N-CA-C 109.079 -0.712 . . . . 0.0 109.079 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . 0.443 HG21 ' HB2' ' B' ' 27' ' ' ASP . 16.0 t -141.74 150.12 19.59 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.53 0 N-CA-C 104.08 -2.563 . . . . 0.0 104.08 178.161 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 14.6 p -145.19 113.94 1.52 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.491 0 N-CA-C 106.677 -1.601 . . . . 0.0 106.677 178.39 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 60.4 ttt-85 -147.83 161.94 40.25 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 106.783 -1.562 . . . . 0.0 106.783 179.465 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -92.99 133.55 36.02 Favored 'General case' 0 N--CA 1.442 -0.834 0 N-CA-C 104.688 -2.338 . . . . 0.0 104.688 178.056 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.536 HD13 ' H ' ' A' ' 21' ' ' ARG . 0.2 OUTLIER -115.6 159.33 21.44 Favored 'General case' 0 C--O 1.238 0.488 0 N-CA-C 105.673 -1.973 . . . . 0.0 105.673 178.34 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.536 ' H ' HD13 ' A' ' 20' ' ' LEU . 17.4 mmt85 -128.91 150.18 50.47 Favored 'General case' 0 CA--C 1.512 -0.505 0 C-N-CA 124.055 0.942 . . . . 0.0 109.565 -179.759 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . 0.464 ' O ' ' HA ' ' B' ' 15' ' ' THR . 90.0 m-85 -142.3 149.83 40.03 Favored 'General case' 0 CA--C 1.515 -0.379 0 N-CA-C 107.568 -1.271 . . . . 0.0 107.568 179.106 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . 0.488 ' HB3' ' HD2' ' A' ' 24' ' ' PRO . 2.0 m -85.67 -175.62 0.65 Allowed Pre-proline 0 CA--C 1.55 0.965 0 C-N-CA 125.021 1.328 . . . . 0.0 111.091 -179.109 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . 0.488 ' HD2' ' HB3' ' A' ' 23' ' ' SER . 39.4 Cg_endo -65.7 -55.06 0.47 Allowed 'Trans proline' 0 C--N 1.357 1.004 0 CA-C-N 121.94 1.729 . . . . 0.0 110.879 -179.485 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 59.9 t -62.0 -40.8 88.61 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.291 0 C-N-CA 123.11 0.564 . . . . 0.0 110.393 -179.772 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -58.46 -50.94 71.92 Favored 'General case' 0 C--O 1.228 -0.051 0 CA-C-N 118.376 0.535 . . . . 0.0 111.597 -179.048 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -65.09 -46.0 82.91 Favored 'General case' 0 CA--C 1.51 -0.563 0 C-N-CA 122.724 0.41 . . . . 0.0 111.311 -179.958 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 39.8 tt0 -54.12 -52.69 60.24 Favored 'General case' 0 N--CA 1.445 -0.708 0 C-N-CA 124.366 1.066 . . . . 0.0 109.69 -179.862 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 22.6 m -63.37 -54.03 43.2 Favored 'General case' 0 N--CA 1.449 -0.493 0 C-N-CA 124.309 1.043 . . . . 0.0 111.034 -179.786 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 34.0 mt -55.55 -44.72 77.46 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.243 0 CA-C-N 118.399 0.545 . . . . 0.0 110.396 -179.331 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 70.1 ttt-85 -62.56 -45.26 93.75 Favored 'General case' 0 C--N 1.33 -0.281 0 C-N-CA 123.179 0.592 . . . . 0.0 110.478 -179.75 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 4.2 mptp? -62.52 -49.21 76.25 Favored 'General case' 0 CA--C 1.517 -0.298 0 C-N-CA 123.085 0.554 . . . . 0.0 109.979 -179.608 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 30.7 tptt -62.12 -50.92 69.97 Favored 'General case' 0 N--CA 1.448 -0.56 0 C-N-CA 122.72 0.408 . . . . 0.0 109.954 -179.331 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -57.0 -47.3 81.15 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 123.824 0.85 . . . . 0.0 111.942 -178.721 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 19.9 tt0 -68.71 -22.46 64.35 Favored 'General case' 0 C--O 1.236 0.394 0 O-C-N 121.147 -0.971 . . . . 0.0 111.018 -179.391 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 24.0 t0 -87.9 -35.73 17.54 Favored 'General case' 0 CA--C 1.522 -0.106 0 C-N-CA 123.635 0.774 . . . . 0.0 110.452 -179.574 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 3.8 t -85.96 -11.43 53.08 Favored 'General case' 0 CA--C 1.536 0.416 0 O-C-N 121.351 -0.843 . . . . 0.0 110.345 179.088 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 86.44 -14.59 54.39 Favored Glycine 0 CA--C 1.527 0.82 0 C-N-CA 125.664 1.602 . . . . 0.0 112.453 -179.669 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 72.2 mt -75.31 112.06 11.21 Favored 'General case' 0 CA--C 1.506 -0.729 0 N-CA-C 105.098 -2.186 . . . . 0.0 105.098 -179.616 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 1.7 t -49.21 152.57 1.15 Allowed 'General case' 0 CA--C 1.538 0.505 0 N-CA-C 108.448 -0.945 . . . . 0.0 108.448 178.645 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 24.3 t -46.5 -35.57 2.61 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.418 0 C-N-CA 125.448 1.499 . . . . 0.0 112.063 -179.326 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -70.84 -47.82 57.27 Favored 'General case' 0 CA--C 1.539 0.535 0 O-C-N 121.337 -0.852 . . . . 0.0 110.325 178.058 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -61.75 -43.3 99.12 Favored 'General case' 0 C--O 1.224 -0.243 0 C-N-CA 124.73 1.212 . . . . 0.0 110.126 179.131 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 61.7 t80 -54.41 -52.89 60.32 Favored 'General case' 0 N--CA 1.449 -0.511 0 C-N-CA 125.247 1.419 . . . . 0.0 109.289 179.658 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.461 HG23 HG23 ' B' ' 45' ' ' ILE . 20.8 mm -56.55 -60.15 2.22 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.209 0 C-N-CA 123.306 0.642 . . . . 0.0 112.439 179.657 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 11.8 ptm180 -57.27 -44.45 83.96 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-N 118.277 0.49 . . . . 0.0 111.3 -178.775 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 22.8 t30 -57.91 -53.7 55.23 Favored 'General case' 0 N--CA 1.455 -0.221 0 C-N-CA 123.722 0.809 . . . . 0.0 112.019 -179.508 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -62.45 -34.16 76.25 Favored 'General case' 0 C--N 1.334 -0.074 0 N-CA-C 113.017 0.747 . . . . 0.0 113.017 -179.435 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -70.7 -41.82 71.47 Favored 'General case' 0 N--CA 1.448 -0.525 0 N-CA-C 111.971 0.36 . . . . 0.0 111.971 -178.719 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 17.6 mt -74.58 -40.96 61.3 Favored 'General case' 0 CA--C 1.513 -0.452 0 C-N-CA 123.028 0.531 . . . . 0.0 112.098 -178.623 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 43.8 m-80 . . . . . 0 C--O 1.252 1.221 0 O-C-N 124.194 0.934 . . . . 0.0 108.621 179.765 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' B' B ' 15' ' ' THR . . . . . 0.464 ' HA ' ' O ' ' A' ' 22' ' ' PHE . 6.9 t . . . . . 0 N--CA 1.432 -1.327 0 CA-C-O 121.845 0.831 . . . . 0.0 111.077 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 36.1 t -136.67 145.11 30.83 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.426 0 N-CA-C 104.225 -2.509 . . . . 0.0 104.225 178.856 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 12.3 p -130.93 112.57 22.37 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.697 0 N-CA-C 104.938 -2.245 . . . . 0.0 104.938 178.923 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 4.4 ttt-85 -142.84 146.75 34.44 Favored 'General case' 0 CA--C 1.51 -0.584 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.804 -179.646 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 87.4 m -93.34 117.96 30.71 Favored 'General case' 0 C--O 1.239 0.514 0 N-CA-C 104.715 -2.328 . . . . 0.0 104.715 178.391 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 14.6 tp -120.38 138.54 53.69 Favored 'General case' 0 C--O 1.236 0.395 0 C-N-CA 124.434 1.094 . . . . 0.0 108.869 -178.742 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 11.2 mtt85 -116.15 161.32 19.11 Favored 'General case' 0 CA--C 1.519 -0.24 0 C-N-CA 124.142 0.977 . . . . 0.0 111.562 -179.177 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 22' ' ' PHE . . . . . 0.407 ' O ' ' HA ' ' A' ' 15' ' ' THR . 82.1 m-85 -143.83 157.64 44.23 Favored 'General case' 0 C--N 1.33 -0.258 0 C-N-CA 125.298 1.439 . . . . 0.0 108.019 -179.839 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 50.3 m -79.94 170.44 15.84 Favored Pre-proline 0 CA--C 1.548 0.89 0 C-N-CA 125.241 1.416 . . . . 0.0 107.369 178.344 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 24' ' ' PRO . . . . . . . . . . . . . 60.8 Cg_endo -69.12 -42.82 3.68 Favored 'Trans proline' 0 C--N 1.347 0.448 0 CA-C-N 121.345 1.516 . . . . 0.0 111.063 -178.868 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 25' ' ' VAL . . . . . . . . . . . . . 4.2 t -60.84 -39.16 80.97 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.475 0 C-N-CA 124.013 0.925 . . . . 0.0 108.916 179.762 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 81.3 mt-10 -69.46 -49.78 51.75 Favored 'General case' 0 C--O 1.22 -0.497 0 C-N-CA 123.55 0.74 . . . . 0.0 109.783 179.685 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 27' ' ' ASP . . . . . 0.443 ' HB2' HG21 ' A' ' 16' ' ' VAL . 2.6 t70 -56.09 -43.29 77.9 Favored 'General case' 0 CA--C 1.513 -0.448 0 C-N-CA 124.559 1.144 . . . . 0.0 111.477 179.635 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 28' ' ' GLU . . . . . . . . . . . . . 34.8 tt0 -65.09 -50.44 66.1 Favored 'General case' 0 N--CA 1.445 -0.724 0 O-C-N 123.927 0.767 . . . . 0.0 108.946 179.773 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 60.5 m -58.68 -51.78 68.48 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 122.979 0.512 . . . . 0.0 109.66 179.692 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 83.9 mt -58.45 -43.8 87.5 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.23 0 C-N-CA 124.337 1.055 . . . . 0.0 109.546 -179.803 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 64.9 ttt180 -62.82 -49.57 74.41 Favored 'General case' 0 CA--C 1.519 -0.223 0 O-C-N 121.587 -0.695 . . . . 0.0 110.005 179.737 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 5.1 mptp? -62.28 -42.99 99.82 Favored 'General case' 0 N--CA 1.454 -0.242 0 CA-C-O 118.044 -0.979 . . . . 0.0 110.408 -179.741 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 33' ' ' LYS . . . . . 0.433 ' HD2' ' HA ' ' B' ' 33' ' ' LYS . 34.7 tptt -70.37 -37.74 74.63 Favored 'General case' 0 CA--C 1.521 -0.135 0 CA-C-N 119.715 1.143 . . . . 0.0 111.369 -179.413 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 34' ' ' ALA . . . . . . . . . . . . . . . -60.82 -49.12 78.76 Favored 'General case' 0 N--CA 1.453 -0.303 0 N-CA-C 107.259 -1.385 . . . . 0.0 107.259 177.999 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 67.9 tt0 -60.7 -44.64 96.32 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 124.233 1.013 . . . . 0.0 110.863 179.85 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 36' ' ' ASP . . . . . . . . . . . . . 20.8 t70 -62.19 -41.73 98.61 Favored 'General case' 0 CA--C 1.519 -0.214 0 C-N-CA 126.781 2.033 . . . . 0.0 110.19 -179.436 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 37' ' ' SER . . . . . . . . . . . . . 8.0 t -82.16 -10.44 59.17 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 123.058 0.543 . . . . 0.0 111.159 179.527 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 71.41 10.95 71.24 Favored Glycine 0 CA--C 1.533 1.17 0 O-C-N 120.776 -1.203 . . . . 0.0 111.302 -178.761 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 39' ' ' LEU . . . . . . . . . . . . . 27.2 mt -107.07 112.63 25.64 Favored 'General case' 0 N--CA 1.451 -0.399 0 C-N-CA 126.486 1.914 . . . . 0.0 106.173 -179.93 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 40' ' ' THR . . . . . . . . . . . . . 6.4 t -45.51 153.78 0.23 Allowed 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 125.957 1.703 . . . . 0.0 110.156 179.476 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 41' ' ' VAL . . . . . . . . . . . . . 89.4 t -45.62 -45.41 4.49 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.246 0 C-N-CA 124.621 1.168 . . . . 0.0 111.686 -178.683 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 42' ' ' SER . . . . . . . . . . . . . 4.3 p -63.64 -42.92 98.09 Favored 'General case' 0 CA--C 1.541 0.628 0 O-C-N 121.117 -0.989 . . . . 0.0 112.063 179.597 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -65.26 -43.42 91.36 Favored 'General case' 0 C--N 1.34 0.157 0 C-N-CA 125.03 1.332 . . . . 0.0 109.193 178.956 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 44' ' ' TYR . . . . . . . . . . . . . 84.8 t80 -58.1 -52.28 66.21 Favored 'General case' 0 N--CA 1.448 -0.527 0 C-N-CA 125.26 1.424 . . . . 0.0 108.497 179.298 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 45' ' ' ILE . . . . . 0.461 HG23 HG23 ' A' ' 45' ' ' ILE . 16.8 mm -57.51 -62.61 0.87 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.393 0 C-N-CA 123.961 0.904 . . . . 0.0 111.261 179.81 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 46' ' ' ARG . . . . . . . . . . . . . 9.0 ptm180 -53.59 -41.17 66.31 Favored 'General case' 0 C--O 1.224 -0.287 0 CA-C-O 118.057 -0.973 . . . . 0.0 112.558 -178.664 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 47' ' ' ASN . . . . . . . . . . . . . 16.1 t30 -70.62 -52.2 22.96 Favored 'General case' 0 N--CA 1.453 -0.321 0 C-N-CA 124.502 1.121 . . . . 0.0 111.187 -179.348 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -58.4 -31.45 67.71 Favored 'General case' 0 CA--C 1.53 0.178 0 C-N-CA 122.908 0.483 . . . . 0.0 112.016 -179.175 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 49' ' ' ALA . . . . . . . . . . . . . . . -74.83 -21.05 59.5 Favored 'General case' 0 N--CA 1.445 -0.686 0 N-CA-C 114.761 1.393 . . . . 0.0 114.761 -179.476 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 10.8 mt -105.38 -34.84 7.71 Favored 'General case' 0 N--CA 1.469 0.52 0 N-CA-C 113.757 1.021 . . . . 0.0 113.757 -178.391 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 51' ' ' ASN . . . . . . . . . . . . . 26.3 m-80 . . . . . 0 C--O 1.252 1.232 0 CA-C-O 116.214 -1.85 . . . . 0.0 113.528 -178.307 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 11.4 t . . . . . 0 N--CA 1.439 -1.025 0 N-CA-C 107.305 -1.369 . . . . 0.0 107.305 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 2.3 p -80.2 148.8 5.49 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.01 0 N-CA-C 105.515 -2.032 . . . . 0.0 105.515 178.245 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 13.1 p -144.81 114.0 1.68 Allowed 'Isoleucine or valine' 0 N--CA 1.441 -0.914 0 N-CA-C 107.541 -1.281 . . . . 0.0 107.541 177.692 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 17.0 ttt85 -145.47 177.72 8.64 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 106.57 -1.641 . . . . 0.0 106.57 178.951 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 29.5 m -128.35 139.69 52.25 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 104.346 -2.464 . . . . 0.0 104.346 179.156 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 77.8 mt -120.16 169.08 10.57 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-N 118.626 0.648 . . . . 0.0 109.764 179.605 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 12.3 mmt-85 -137.81 136.09 36.89 Favored 'General case' 0 C--O 1.237 0.397 0 C-N-CA 126.281 1.832 . . . . 0.0 109.38 -179.975 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . 0.41 ' H ' HG13 ' B' ' 16' ' ' VAL . 24.6 m-85 -133.95 152.58 51.91 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 106.715 -1.587 . . . . 0.0 106.715 178.76 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 4.9 m -69.04 166.93 23.43 Favored Pre-proline 0 CA--C 1.543 0.681 0 N-CA-C 107.734 -1.21 . . . . 0.0 107.734 178.929 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 19.5 Cg_endo -56.84 -48.62 17.66 Favored 'Trans proline' 0 N--CA 1.461 -0.425 0 C-N-CA 121.801 1.667 . . . . 0.0 112.21 -178.975 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 98.0 t -59.94 -43.67 92.81 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.471 0 C-N-CA 126.171 1.788 . . . . 0.0 110.722 179.861 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 88.0 mt-10 -67.39 -46.05 74.43 Favored 'General case' 0 C--N 1.334 -0.076 0 C-N-CA 124.991 1.316 . . . . 0.0 110.7 -178.827 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 30.5 t70 -62.4 -42.11 99.18 Favored 'General case' 0 CA--C 1.519 -0.213 0 N-CA-C 109.12 -0.696 . . . . 0.0 109.12 179.443 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 16.5 tt0 -66.28 -37.03 84.5 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 124.298 1.039 . . . . 0.0 109.79 178.883 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 95.3 m -64.35 -55.05 23.8 Favored 'General case' 0 CA--C 1.531 0.224 0 N-CA-C 106.949 -1.5 . . . . 0.0 106.949 178.68 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 75.1 mt -56.46 -45.68 81.95 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.247 0 C-N-CA 124.219 1.008 . . . . 0.0 108.987 -179.882 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 74.6 ttt180 -59.95 -47.54 85.38 Favored 'General case' 0 N--CA 1.457 -0.091 0 C-N-CA 123.511 0.724 . . . . 0.0 110.966 -179.785 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 11.7 mptt -64.02 -48.73 75.16 Favored 'General case' 0 CA--C 1.522 -0.109 0 CA-C-O 118.15 -0.928 . . . . 0.0 110.647 -179.792 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 24.9 mmtp -60.6 -46.12 91.42 Favored 'General case' 0 N--CA 1.463 0.213 0 CA-C-N 119.019 0.827 . . . . 0.0 109.915 -179.539 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -56.93 -55.28 36.63 Favored 'General case' 0 N--CA 1.454 -0.23 0 C-N-CA 124.013 0.925 . . . . 0.0 110.286 179.787 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 27.5 tt0 -64.43 -35.07 79.72 Favored 'General case' 0 N--CA 1.455 -0.21 0 CA-C-O 119.072 -0.49 . . . . 0.0 112.193 -178.761 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 41.8 t0 -66.21 -39.74 89.85 Favored 'General case' 0 N--CA 1.466 0.325 0 N-CA-C 107.838 -1.171 . . . . 0.0 107.838 179.484 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 22.9 t -75.57 -10.63 59.61 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 125.482 1.513 . . . . 0.0 110.211 178.374 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 73.06 4.15 62.3 Favored Glycine 0 CA--C 1.531 1.068 0 C-N-CA 125.551 1.548 . . . . 0.0 113.962 -179.984 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 12.9 mt -106.34 128.03 53.7 Favored 'General case' 0 CA--C 1.51 -0.584 0 N-CA-C 105.414 -2.069 . . . . 0.0 105.414 179.749 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 8.7 t -50.82 152.43 2.1 Favored 'General case' 0 CA--C 1.539 0.546 0 CA-C-O 121.435 0.636 . . . . 0.0 110.571 179.256 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 52.0 t -46.63 -40.49 4.55 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.166 0 C-N-CA 126.089 1.756 . . . . 0.0 111.908 -179.78 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 3.5 p -61.46 -42.58 99.0 Favored 'General case' 0 CA--C 1.535 0.365 0 CA-C-N 119.567 1.076 . . . . 0.0 111.37 -179.732 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -70.65 -42.13 71.23 Favored 'General case' 0 C--O 1.222 -0.391 0 N-CA-C 108.527 -0.916 . . . . 0.0 108.527 178.343 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 56.0 t80 -55.08 -51.5 66.19 Favored 'General case' 0 CA--C 1.535 0.396 0 CA-C-N 118.838 0.745 . . . . 0.0 109.083 179.235 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 18.1 mm -56.83 -61.44 1.23 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.19 0 C-N-CA 125.173 1.389 . . . . 0.0 110.207 179.686 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 11.8 ptt180 -51.58 -44.3 62.73 Favored 'General case' 0 C--O 1.222 -0.377 0 C-N-CA 123.655 0.782 . . . . 0.0 110.738 -179.135 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 2.2 t30 -62.07 -56.85 14.81 Favored 'General case' 0 N--CA 1.452 -0.338 0 C-N-CA 123.882 0.873 . . . . 0.0 110.031 179.016 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -59.12 -32.05 69.49 Favored 'General case' 0 C--O 1.224 -0.256 0 N-CA-C 113.521 0.934 . . . . 0.0 113.521 -178.645 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -76.28 -24.5 54.45 Favored 'General case' 0 CA--C 1.533 0.322 0 N-CA-C 113.696 0.999 . . . . 0.0 113.696 -179.485 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 17.9 mt -97.46 -28.3 14.05 Favored 'General case' 0 N--CA 1.466 0.339 0 C-N-CA 123.18 0.592 . . . . 0.0 110.288 179.62 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 43.1 m-80 . . . . . 0 C--O 1.253 1.276 0 C-N-CA 125.521 1.528 . . . . 0.0 108.335 179.133 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 5.5 t . . . . . 0 N--CA 1.443 -0.8 0 CA-C-O 123.986 1.85 . . . . 0.0 110.711 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' B' B ' 16' ' ' VAL . . . . . 0.41 HG13 ' H ' ' A' ' 22' ' ' PHE . 0.3 OUTLIER -130.24 148.46 33.16 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.794 0 N-CA-C 102.209 -3.256 . . . . 0.0 102.209 178.316 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 9.3 p -147.08 98.79 0.41 Allowed 'Isoleucine or valine' 0 N--CA 1.436 -1.173 0 N-CA-C 104.559 -2.386 . . . . 0.0 104.559 179.201 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 16.8 ttt85 -138.74 152.37 47.91 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.105 -0.952 . . . . 0.0 110.945 -179.265 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 19.6 m -91.73 135.89 33.56 Favored 'General case' 0 C--N 1.326 -0.435 0 C-N-CA 125.316 1.446 . . . . 0.0 108.195 179.92 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 20' ' ' LEU . . . . . 0.403 HD23 ' CZ ' ' B' ' 22' ' ' PHE . 0.2 OUTLIER -139.09 134.82 33.43 Favored 'General case' 0 C--O 1.237 0.407 0 N-CA-C 108.84 -0.8 . . . . 0.0 108.84 179.085 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 50.1 mtm-85 -115.67 159.1 21.79 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 124.475 1.11 . . . . 0.0 110.798 179.363 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 22' ' ' PHE . . . . . 0.403 ' CZ ' HD23 ' B' ' 20' ' ' LEU . 31.9 m-85 -145.43 154.24 42.04 Favored 'General case' 0 C--O 1.238 0.45 0 C-N-CA 125.398 1.479 . . . . 0.0 108.18 179.98 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 15.4 m -67.85 168.01 14.55 Favored Pre-proline 0 CA--C 1.537 0.46 0 N-CA-C 108.568 -0.901 . . . . 0.0 108.568 178.82 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 24' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -63.09 -42.19 24.6 Favored 'Trans proline' 0 N--CA 1.457 -0.63 0 CA-C-N 120.291 1.14 . . . . 0.0 109.329 179.356 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 25' ' ' VAL . . . . . . . . . . . . . 75.6 t -57.07 -44.75 83.53 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.585 0 C-N-CA 123.797 0.839 . . . . 0.0 109.637 178.925 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 49.3 mt-10 -66.23 -52.19 50.23 Favored 'General case' 0 N--CA 1.454 -0.23 0 C-N-CA 124.355 1.062 . . . . 0.0 110.392 -179.785 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 27' ' ' ASP . . . . . . . . . . . . . 34.9 t70 -60.27 -39.81 88.16 Favored 'General case' 0 C--O 1.223 -0.295 0 C-N-CA 123.692 0.797 . . . . 0.0 111.471 -179.237 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 28' ' ' GLU . . . . . . . . . . . . . 79.6 mt-10 -63.92 -50.91 66.85 Favored 'General case' 0 N--CA 1.453 -0.311 0 N-CA-C 107.616 -1.253 . . . . 0.0 107.616 178.506 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 90.2 m -55.1 -58.96 5.53 Favored 'General case' 0 CA--C 1.531 0.219 0 N-CA-C 109.104 -0.702 . . . . 0.0 109.104 179.618 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 92.9 mt -55.06 -47.03 77.53 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.353 0 C-N-CA 124.29 1.036 . . . . 0.0 110.132 -179.286 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 61.7 ttt180 -58.9 -48.83 80.05 Favored 'General case' 0 CA--C 1.52 -0.207 0 CA-C-N 119.093 0.861 . . . . 0.0 110.542 -179.752 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 10.6 mptt -61.7 -49.18 77.49 Favored 'General case' 0 C--O 1.22 -0.466 0 CA-C-O 118.546 -0.74 . . . . 0.0 109.889 -179.248 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 22.8 mmtp -56.71 -49.79 74.1 Favored 'General case' 0 CA--C 1.517 -0.319 0 C-N-CA 124.32 1.048 . . . . 0.0 109.574 -178.664 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 34' ' ' ALA . . . . . . . . . . . . . . . -56.19 -58.58 7.36 Favored 'General case' 0 N--CA 1.446 -0.646 0 C-N-CA 125.858 1.663 . . . . 0.0 110.5 179.967 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 11.6 tt0 -67.38 -20.21 65.52 Favored 'General case' 0 N--CA 1.467 0.391 0 N-CA-C 113.599 0.963 . . . . 0.0 113.599 -177.796 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 36' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -92.15 2.96 56.27 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 126.401 1.88 . . . . 0.0 110.7 178.884 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 37' ' ' SER . . . . . . . . . . . . . 18.6 t -122.59 -6.35 8.65 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 125.779 1.632 . . . . 0.0 111.021 -179.921 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 73.87 31.5 60.07 Favored Glycine 0 CA--C 1.527 0.783 0 N-CA-C 110.176 -1.169 . . . . 0.0 110.176 -179.455 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 39' ' ' LEU . . . . . . . . . . . . . 59.6 mt -128.19 129.56 46.66 Favored 'General case' 0 N--CA 1.446 -0.637 0 C-N-CA 125.959 1.704 . . . . 0.0 108.83 -178.491 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 40' ' ' THR . . . . . . . . . . . . . 1.8 t -66.59 152.4 45.37 Favored 'General case' 0 CA--C 1.541 0.611 0 N-CA-C 104.344 -2.465 . . . . 0.0 104.344 176.626 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 41' ' ' VAL . . . . . . . . . . . . . 55.0 t -47.58 -40.94 7.6 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.338 0 C-N-CA 124.596 1.158 . . . . 0.0 111.118 179.157 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 42' ' ' SER . . . . . . . . . . . . . 5.1 p -61.77 -44.21 97.33 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-N 120.007 1.276 . . . . 0.0 111.08 179.598 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -65.76 -40.53 92.13 Favored 'General case' 0 C--O 1.226 -0.18 0 C-N-CA 124.008 0.923 . . . . 0.0 109.059 178.776 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 44' ' ' TYR . . . . . . . . . . . . . 53.4 t80 -60.64 -52.64 64.28 Favored 'General case' 0 CA--C 1.534 0.35 0 N-CA-C 108.114 -1.069 . . . . 0.0 108.114 178.904 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 45' ' ' ILE . . . . . . . . . . . . . 23.2 mm -54.53 -62.19 0.8 Allowed 'Isoleucine or valine' 0 C--N 1.34 0.169 0 C-N-CA 124.537 1.135 . . . . 0.0 110.672 -179.888 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 46' ' ' ARG . . . . . . . . . . . . . 22.2 ptt180 -54.75 -47.03 74.34 Favored 'General case' 0 C--O 1.223 -0.291 0 CA-C-O 119.302 -0.38 . . . . 0.0 111.711 -178.856 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 47' ' ' ASN . . . . . . . . . . . . . 23.7 t30 -61.08 -52.04 66.62 Favored 'General case' 0 N--CA 1.448 -0.528 0 CA-C-O 118.282 -0.866 . . . . 0.0 111.132 -178.814 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -63.42 -27.86 69.58 Favored 'General case' 0 C--O 1.225 -0.223 0 C-N-CA 124.038 0.935 . . . . 0.0 112.075 179.776 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 49' ' ' ALA . . . . . . . . . . . . . . . -77.75 -34.8 52.29 Favored 'General case' 0 N--CA 1.457 -0.082 0 O-C-N 121.391 -0.818 . . . . 0.0 111.692 -179.914 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 38.1 mt -82.51 -46.16 13.77 Favored 'General case' 0 C--N 1.33 -0.249 0 C-N-CA 122.874 0.469 . . . . 0.0 110.629 -179.06 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 51' ' ' ASN . . . . . . . . . . . . . 42.5 m-80 . . . . . 0 C--O 1.248 0.981 0 C-N-CA 124.768 1.227 . . . . 0.0 110.668 -179.721 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 4.2 t . . . . . 0 N--CA 1.44 -0.941 0 CA-C-O 122.249 1.023 . . . . 0.0 108.793 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 95.2 t -97.86 145.34 9.66 Favored 'Isoleucine or valine' 0 CA--C 1.505 -0.755 0 C-N-CA 126.747 2.019 . . . . 0.0 105.918 179.308 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 7.8 p -145.62 99.95 0.51 Allowed 'Isoleucine or valine' 0 N--CA 1.441 -0.908 0 CA-C-O 122.6 1.191 . . . . 0.0 108.484 178.066 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 26.4 mtt-85 -143.12 157.39 44.56 Favored 'General case' 0 CA--C 1.511 -0.531 0 CA-C-N 115.084 -0.962 . . . . 0.0 110.234 178.824 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 96.6 m -86.42 100.5 12.39 Favored 'General case' 0 N--CA 1.446 -0.671 0 N-CA-C 106.664 -1.606 . . . . 0.0 106.664 179.548 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -95.4 86.68 4.57 Favored 'General case' 0 C--N 1.323 -0.579 0 C-N-CA 126.806 2.042 . . . . 0.0 107.321 -179.27 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 14.0 mtp180 -77.36 162.51 27.21 Favored 'General case' 0 N--CA 1.453 -0.316 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.64 179.246 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 92.7 m-85 -139.8 171.08 14.73 Favored 'General case' 0 CA--C 1.516 -0.349 0 C-N-CA 125.966 1.707 . . . . 0.0 108.068 178.985 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 7.7 m -106.2 172.56 3.83 Favored Pre-proline 0 CA--C 1.547 0.848 0 N-CA-C 108.063 -1.088 . . . . 0.0 108.063 179.306 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 92.5 Cg_endo -70.67 -33.99 12.27 Favored 'Trans proline' 0 N--CA 1.46 -0.482 0 CA-C-N 122.163 1.808 . . . . 0.0 113.341 -177.545 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 35.7 t -77.31 -36.3 23.77 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.31 0 N-CA-C 107.209 -1.404 . . . . 0.0 107.209 179.187 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 73.9 mt-10 -61.28 -54.1 48.35 Favored 'General case' 0 C--N 1.343 0.285 0 N-CA-C 107.523 -1.288 . . . . 0.0 107.523 178.709 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -57.34 -46.53 83.2 Favored 'General case' 0 C--O 1.217 -0.623 0 C-N-CA 125.068 1.347 . . . . 0.0 111.181 -179.838 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 13.3 tt0 -58.37 -51.38 70.07 Favored 'General case' 0 N--CA 1.452 -0.33 0 CA-C-O 118.726 -0.654 . . . . 0.0 111.204 179.745 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 85.5 m -57.33 -52.5 65.12 Favored 'General case' 0 CA--C 1.536 0.423 0 CA-C-N 118.766 0.712 . . . . 0.0 109.52 179.454 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 96.0 mt -56.89 -47.53 82.94 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.178 0 C-N-CA 123.392 0.677 . . . . 0.0 110.356 -179.299 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 33.1 ttt85 -61.78 -44.83 96.12 Favored 'General case' 0 N--CA 1.448 -0.545 0 C-N-CA 123.875 0.87 . . . . 0.0 111.769 -179.082 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 14.0 mptt -59.17 -51.22 70.95 Favored 'General case' 0 CA--C 1.516 -0.33 0 CA-C-N 118.549 0.613 . . . . 0.0 109.649 179.469 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 4.6 mptp? -62.9 -47.18 84.4 Favored 'General case' 0 CA--C 1.515 -0.379 0 CA-C-O 118.135 -0.936 . . . . 0.0 110.637 -179.01 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -56.15 -55.48 32.6 Favored 'General case' 0 N--CA 1.451 -0.391 0 C-N-CA 124.217 1.007 . . . . 0.0 109.776 179.505 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 5.3 tt0 -60.25 -38.65 84.13 Favored 'General case' 0 C--O 1.234 0.241 0 O-C-N 123.54 0.525 . . . . 0.0 111.545 -178.113 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -72.08 -24.93 61.58 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 123.872 0.869 . . . . 0.0 111.196 179.458 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 2.2 t -83.52 -8.15 59.4 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 126.477 1.911 . . . . 0.0 109.023 178.129 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 77.88 8.66 87.27 Favored Glycine 0 CA--C 1.529 0.957 0 CA-C-O 118.812 -0.994 . . . . 0.0 111.716 -179.029 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 40.1 mt -116.55 154.98 29.47 Favored 'General case' 0 N--CA 1.452 -0.344 0 CA-C-N 119.758 1.779 . . . . 0.0 111.457 -178.435 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . 0.433 HG22 ' H ' ' A' ' 40' ' ' THR . 0.9 OUTLIER -74.99 151.61 38.78 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 104.116 -2.549 . . . . 0.0 104.116 176.159 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 19.4 m -51.2 -31.29 11.06 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.929 0 CA-C-N 114.873 -1.058 . . . . 0.0 110.937 178.93 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 29.3 t -61.0 -58.94 6.32 Favored 'General case' 0 CA--C 1.536 0.435 0 CA-C-N 119.421 1.009 . . . . 0.0 108.936 178.549 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -58.98 -39.52 82.02 Favored 'General case' 0 C--O 1.223 -0.3 0 C-N-CA 123.662 0.785 . . . . 0.0 109.385 178.78 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 77.8 t80 -60.78 -50.19 74.45 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-O 119.084 -0.484 . . . . 0.0 109.737 179.059 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 10.8 mm -55.6 -62.96 0.66 Allowed 'Isoleucine or valine' 0 N--CA 1.463 0.182 0 C-N-CA 125.272 1.429 . . . . 0.0 109.904 179.99 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 27.3 ptt180 -53.08 -44.09 67.28 Favored 'General case' 0 N--CA 1.454 -0.271 0 C-N-CA 123.293 0.637 . . . . 0.0 110.708 -178.579 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 39.1 t30 -63.2 -55.98 20.5 Favored 'General case' 0 N--CA 1.45 -0.444 0 C-N-CA 123.502 0.721 . . . . 0.0 111.583 -179.798 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -61.35 -28.35 69.16 Favored 'General case' 0 N--CA 1.463 0.223 0 C-N-CA 123.965 0.906 . . . . 0.0 112.096 -178.91 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -74.93 -27.62 60.28 Favored 'General case' 0 N--CA 1.453 -0.281 0 N-CA-C 113.022 0.749 . . . . 0.0 113.022 -179.468 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 13.7 mt -93.83 -44.64 8.02 Favored 'General case' 0 C--N 1.332 -0.193 0 C-N-CA 122.849 0.46 . . . . 0.0 110.747 -179.378 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 79.1 m-20 . . . . . 0 C--O 1.244 0.789 0 C-N-CA 124.622 1.169 . . . . 0.0 111.249 -178.229 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 3.4 t . . . . . 0 N--CA 1.451 -0.378 0 N-CA-C 108.567 -0.901 . . . . 0.0 108.567 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 12.1 t -128.46 115.82 39.29 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.663 0 N-CA-C 103.944 -2.613 . . . . 0.0 103.944 178.954 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 9.0 p -116.74 107.14 21.69 Favored 'Isoleucine or valine' 0 C--O 1.237 0.396 0 CA-C-O 121.957 0.884 . . . . 0.0 110.819 -178.898 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 36.4 mtt180 -133.64 -175.7 3.91 Favored 'General case' 0 C--O 1.239 0.525 0 N-CA-C 108.622 -0.881 . . . . 0.0 108.622 178.189 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 1.9 m -122.34 105.91 10.61 Favored 'General case' 0 N--CA 1.448 -0.555 0 N-CA-C 102.155 -3.276 . . . . 0.0 102.155 178.621 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 15.5 tp -112.27 89.74 3.15 Favored 'General case' 0 N--CA 1.442 -0.836 0 C-N-CA 125.241 1.416 . . . . 0.0 110.454 -177.975 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -63.38 157.42 23.18 Favored 'General case' 0 N--CA 1.452 -0.347 0 C-N-CA 124.614 1.166 . . . . 0.0 110.125 178.177 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 22' ' ' PHE . . . . . . . . . . . . . 88.2 m-85 -138.65 143.63 39.32 Favored 'General case' 0 C--O 1.236 0.389 0 N-CA-C 103.915 -2.624 . . . . 0.0 103.915 177.198 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 23' ' ' SER . . . . . 0.407 ' HB3' ' HD2' ' B' ' 24' ' ' PRO . 3.3 m -73.88 169.41 18.94 Favored Pre-proline 0 C--N 1.32 -0.692 0 C-N-CA 124.204 1.002 . . . . 0.0 109.535 -179.144 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 24' ' ' PRO . . . . . 0.407 ' HD2' ' HB3' ' B' ' 23' ' ' SER . 33.9 Cg_endo -63.25 -43.61 17.93 Favored 'Trans proline' 0 N--CA 1.46 -0.493 0 C-N-CA 121.401 1.401 . . . . 0.0 111.277 -179.371 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 25' ' ' VAL . . . . . . . . . . . . . 24.6 t -66.68 -39.91 84.88 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.298 0 C-N-CA 124.575 1.15 . . . . 0.0 110.313 -179.92 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 83.7 mt-10 -67.13 -44.25 80.34 Favored 'General case' 0 C--N 1.339 0.115 0 N-CA-C 109.359 -0.608 . . . . 0.0 109.359 -179.854 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 27' ' ' ASP . . . . . . . . . . . . . 28.9 t70 -61.3 -44.86 96.51 Favored 'General case' 0 C--O 1.214 -0.783 0 C-N-CA 123.739 0.815 . . . . 0.0 109.131 179.305 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 28' ' ' GLU . . . . . . . . . . . . . 72.7 tt0 -57.64 -52.91 63.51 Favored 'General case' 0 N--CA 1.445 -0.698 0 C-N-CA 125.019 1.328 . . . . 0.0 108.892 178.398 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 96.2 m -60.49 -53.39 58.1 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-N 120.343 1.429 . . . . 0.0 110.36 179.316 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 50.4 mt -55.3 -49.98 68.43 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.272 0 C-N-CA 123.099 0.559 . . . . 0.0 109.761 -179.513 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 31.8 ttt85 -62.09 -43.4 98.92 Favored 'General case' 0 CA--C 1.51 -0.593 0 CA-C-O 117.425 -1.274 . . . . 0.0 110.908 -179.17 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 9.7 mptt -61.11 -48.81 79.95 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 119.85 1.205 . . . . 0.0 109.164 -179.828 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -63.61 -49.34 73.69 Favored 'General case' 0 N--CA 1.455 -0.186 0 CA-C-N 117.988 0.358 . . . . 0.0 110.183 -179.133 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 34' ' ' ALA . . . . . . . . . . . . . . . -56.3 -57.04 13.96 Favored 'General case' 0 N--CA 1.452 -0.326 0 C-N-CA 126.41 1.884 . . . . 0.0 111.069 179.866 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 59.8 tt0 -60.94 -42.65 98.61 Favored 'General case' 0 C--O 1.233 0.202 0 C-N-CA 125.181 1.392 . . . . 0.0 111.286 -178.454 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 36' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -65.52 -40.86 93.44 Favored 'General case' 0 C--N 1.333 -0.134 0 C-N-CA 123.604 0.762 . . . . 0.0 108.957 179.622 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 37' ' ' SER . . . . . . . . . . . . . 9.9 t -77.77 -4.77 48.1 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 124.151 0.981 . . . . 0.0 110.128 178.553 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 63.53 25.9 69.17 Favored Glycine 0 CA--C 1.529 0.948 0 C-N-CA 124.662 1.125 . . . . 0.0 112.912 -179.842 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 39' ' ' LEU . . . . . . . . . . . . . 40.2 mt -119.19 120.94 38.56 Favored 'General case' 0 CA--C 1.507 -0.692 0 N-CA-C 105.439 -2.06 . . . . 0.0 105.439 179.729 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 40' ' ' THR . . . . . . . . . . . . . 12.8 t -53.54 148.87 8.71 Favored 'General case' 0 C--O 1.237 0.407 0 N-CA-C 108.43 -0.952 . . . . 0.0 108.43 178.44 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 41' ' ' VAL . . . . . . . . . . . . . 22.0 m -48.23 -34.3 4.8 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.721 0 CA-C-N 114.79 -1.096 . . . . 0.0 112.142 -179.149 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 42' ' ' SER . . . . . . . . . . . . . 22.9 t -61.27 -49.96 74.96 Favored 'General case' 0 CA--C 1.544 0.744 0 CA-C-N 119.611 1.096 . . . . 0.0 110.143 178.868 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -67.51 -43.42 80.92 Favored 'General case' 0 C--O 1.225 -0.212 0 C-N-CA 123.592 0.757 . . . . 0.0 109.078 178.722 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 44' ' ' TYR . . . . . . . . . . . . . 74.5 t80 -54.58 -50.47 67.92 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 123.163 0.585 . . . . 0.0 109.722 179.529 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 45' ' ' ILE . . . . . . . . . . . . . 12.4 mm -57.28 -64.23 0.55 Allowed 'Isoleucine or valine' 0 C--N 1.341 0.208 0 C-N-CA 125.762 1.625 . . . . 0.0 110.336 179.834 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 46' ' ' ARG . . . . . . . . . . . . . 21.9 ptt180 -53.12 -46.83 68.92 Favored 'General case' 0 C--O 1.222 -0.361 0 CA-C-O 119.148 -0.453 . . . . 0.0 111.06 -178.267 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 47' ' ' ASN . . . . . . . . . . . . . 34.5 t30 -57.76 -51.57 69.04 Favored 'General case' 0 N--CA 1.453 -0.279 0 CA-C-O 118.819 -0.61 . . . . 0.0 111.288 -179.527 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -61.2 -32.77 72.53 Favored 'General case' 0 CA--C 1.53 0.206 0 C-N-CA 123.326 0.651 . . . . 0.0 111.366 -179.899 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 49' ' ' ALA . . . . . . . . . . . . . . . -77.53 -17.72 57.66 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 124.416 1.086 . . . . 0.0 113.729 -179.438 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 22.0 mt -102.84 -37.24 7.94 Favored 'General case' 0 CA--C 1.517 -0.306 0 CA-C-N 118.857 0.753 . . . . 0.0 110.987 -179.546 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 51' ' ' ASN . . . . . . . . . . . . . 7.4 m-80 . . . . . 0 C--O 1.248 1.02 0 C-N-CA 125.302 1.441 . . . . 0.0 107.953 179.704 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . 0.507 ' CG2' HH11 ' B' ' 21' ' ' ARG . 7.2 t . . . . . 0 N--CA 1.45 -0.446 0 CA-C-O 122.179 0.99 . . . . 0.0 108.861 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 18.0 t -91.85 149.15 4.22 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.724 0 N-CA-C 106.069 -1.826 . . . . 0.0 106.069 178.297 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 10.4 p -139.82 90.62 0.6 Allowed 'Isoleucine or valine' 0 N--CA 1.442 -0.863 0 N-CA-C 104.701 -2.333 . . . . 0.0 104.701 177.321 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 50.6 ttt180 -116.02 170.74 8.26 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 114.519 -1.219 . . . . 0.0 108.645 -179.288 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 10.8 m -117.09 128.34 55.05 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 106.846 -1.539 . . . . 0.0 106.846 179.779 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -125.9 150.47 47.91 Favored 'General case' 0 C--O 1.235 0.31 0 C-N-CA 124.949 1.3 . . . . 0.0 109.235 -179.362 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 68.5 mtt180 -137.8 158.7 43.82 Favored 'General case' 0 N--CA 1.447 -0.587 0 C-N-CA 125.411 1.485 . . . . 0.0 108.232 178.439 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 50.0 m-85 -145.12 156.57 43.96 Favored 'General case' 0 C--O 1.237 0.415 0 N-CA-C 107.84 -1.17 . . . . 0.0 107.84 179.687 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -68.91 168.9 12.92 Favored Pre-proline 0 CA--C 1.543 0.704 0 N-CA-C 107.421 -1.326 . . . . 0.0 107.421 178.7 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 25.3 Cg_endo -61.93 -45.06 17.69 Favored 'Trans proline' 0 N--CA 1.456 -0.702 0 CA-C-N 120.701 1.286 . . . . 0.0 111.264 -178.761 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 72.1 t -65.82 -42.6 92.57 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.29 0 C-N-CA 123.077 0.551 . . . . 0.0 109.908 179.536 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 7.2 mm-40 -60.35 -45.38 93.68 Favored 'General case' 0 CA--C 1.531 0.223 0 C-N-CA 123.307 0.643 . . . . 0.0 109.358 -179.893 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 26.9 t70 -66.59 -44.03 83.29 Favored 'General case' 0 C--O 1.221 -0.416 0 CA-C-O 118.984 -0.532 . . . . 0.0 110.223 179.562 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 31.7 tt0 -58.08 -43.55 87.07 Favored 'General case' 0 CA--C 1.531 0.213 0 C-N-CA 124.758 1.223 . . . . 0.0 109.055 178.976 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 37.4 m -61.22 -50.63 72.31 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 124.283 1.033 . . . . 0.0 108.634 179.273 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 64.7 mt -61.49 -41.34 89.68 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.327 0 N-CA-C 109.262 -0.644 . . . . 0.0 109.262 179.677 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 23.3 ttp85 -60.39 -46.39 90.14 Favored 'General case' 0 N--CA 1.461 0.099 0 C-N-CA 124.003 0.921 . . . . 0.0 109.575 -179.627 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 1.9 mptm? -59.98 -59.04 6.05 Favored 'General case' 0 N--CA 1.45 -0.453 0 C-N-CA 124.993 1.317 . . . . 0.0 110.956 179.537 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 17.5 tptt -60.84 -40.86 94.43 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-O 118.576 -0.726 . . . . 0.0 111.588 -177.479 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -58.45 -51.65 68.94 Favored 'General case' 0 N--CA 1.452 -0.348 0 N-CA-C 108.596 -0.89 . . . . 0.0 108.596 178.813 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 21.8 tt0 -62.17 -41.99 98.84 Favored 'General case' 0 CA--C 1.529 0.157 0 C-N-CA 123.238 0.615 . . . . 0.0 112.093 -179.565 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 38.7 t70 -66.56 -22.88 66.15 Favored 'General case' 0 C--O 1.232 0.167 0 C-N-CA 126.562 1.945 . . . . 0.0 111.281 -179.856 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 10.4 t -97.15 -8.28 30.47 Favored 'General case' 0 N--CA 1.449 -0.523 0 C-N-CA 127.076 2.151 . . . . 0.0 110.994 179.688 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 64.11 31.66 81.59 Favored Glycine 0 CA--C 1.532 1.134 0 O-C-N 120.723 -1.236 . . . . 0.0 111.418 -179.327 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 55.7 mt -127.8 132.54 49.47 Favored 'General case' 0 N--CA 1.448 -0.536 0 N-CA-C 105.2 -2.148 . . . . 0.0 105.2 -179.981 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 8.4 t -61.75 152.76 30.35 Favored 'General case' 0 CA--C 1.538 0.5 0 N-CA-C 107.692 -1.225 . . . . 0.0 107.692 178.679 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 24.1 t -48.33 -41.32 10.8 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.289 0 C-N-CA 124.549 1.14 . . . . 0.0 111.755 -179.974 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . 0.432 ' HA ' HD21 ' B' ' 20' ' ' LEU . 13.5 p -63.65 -38.25 90.39 Favored 'General case' 0 CA--C 1.532 0.255 0 O-C-N 121.024 -1.048 . . . . 0.0 112.08 179.841 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -69.66 -46.86 65.17 Favored 'General case' 0 C--O 1.222 -0.354 0 N-CA-C 107.607 -1.257 . . . . 0.0 107.607 178.334 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 69.6 t80 -52.87 -46.31 67.85 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 123.973 0.909 . . . . 0.0 110.112 179.152 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 14.8 mm -56.98 -63.57 0.63 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.315 0 C-N-CA 124.044 0.938 . . . . 0.0 110.526 179.429 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 12.4 ptt180 -55.47 -45.16 76.94 Favored 'General case' 0 C--O 1.222 -0.365 0 C-N-CA 123.497 0.719 . . . . 0.0 110.989 -178.55 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 32.2 t30 -58.69 -55.79 30.6 Favored 'General case' 0 N--CA 1.449 -0.521 0 C-N-CA 124.601 1.16 . . . . 0.0 109.065 -179.189 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -61.77 -25.9 67.75 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 123.065 0.546 . . . . 0.0 112.442 179.637 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -79.07 -19.38 51.44 Favored 'General case' 0 CA--C 1.536 0.44 0 N-CA-C 113.341 0.867 . . . . 0.0 113.341 179.523 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 7.9 mt -115.3 -29.03 6.7 Favored 'General case' 0 N--CA 1.466 0.328 0 N-CA-C 114.133 1.16 . . . . 0.0 114.133 -177.966 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 2.0 m-80 . . . . . 0 C--O 1.249 1.048 0 C-N-CA 125.512 1.525 . . . . 0.0 110.3 -178.183 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 7.9 t . . . . . 0 N--CA 1.449 -0.483 0 N-CA-C 106.201 -1.777 . . . . 0.0 106.201 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 9.3 p -109.98 155.99 11.03 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.813 0 N-CA-C 104.619 -2.363 . . . . 0.0 104.619 177.391 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 14.2 p -138.79 122.18 19.3 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.734 0 N-CA-C 106.305 -1.739 . . . . 0.0 106.305 177.964 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 23.8 ttt180 -140.65 159.09 42.97 Favored 'General case' 0 CA--C 1.516 -0.334 0 CA-C-O 122.826 1.298 . . . . 0.0 111.44 179.565 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 1.3 m -108.06 102.47 11.63 Favored 'General case' 0 N--CA 1.445 -0.71 0 N-CA-C 101.294 -3.595 . . . . 0.0 101.294 179.693 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 20' ' ' LEU . . . . . 0.432 HD21 ' HA ' ' A' ' 42' ' ' SER . 0.2 OUTLIER -108.52 120.28 41.98 Favored 'General case' 0 CA--C 1.515 -0.372 0 C-N-CA 124.437 1.095 . . . . 0.0 108.375 -178.504 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' B' B ' 21' ' ' ARG . . . . . 0.507 HH11 ' CG2' ' A' ' 15' ' ' THR . 24.2 mtt180 -95.71 153.65 17.62 Favored 'General case' 0 N--CA 1.449 -0.493 0 N-CA-C 109.109 -0.7 . . . . 0.0 109.109 179.188 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 22' ' ' PHE . . . . . . . . . . . . . 92.9 m-85 -134.88 144.27 47.44 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 106.728 -1.582 . . . . 0.0 106.728 -179.814 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -74.78 171.16 12.28 Favored Pre-proline 0 CA--C 1.544 0.741 0 N-CA-C 108.075 -1.083 . . . . 0.0 108.075 179.948 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 24' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -66.94 -31.32 38.12 Favored 'Trans proline' 0 N--CA 1.459 -0.547 0 C-N-CA 121.472 1.448 . . . . 0.0 113.562 -178.332 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 25' ' ' VAL . . . . . . . . . . . . . 89.8 t -75.37 -40.8 42.81 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.307 0 N-CA-C 109.031 -0.729 . . . . 0.0 109.031 -179.832 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -62.86 -48.18 80.13 Favored 'General case' 0 C--O 1.217 -0.631 0 N-CA-C 108.164 -1.051 . . . . 0.0 108.164 179.889 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 27' ' ' ASP . . . . . . . . . . . . . 20.9 t0 -56.03 -48.51 75.84 Favored 'General case' 0 CA--C 1.515 -0.385 0 C-N-CA 124.899 1.28 . . . . 0.0 111.169 -179.514 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 28' ' ' GLU . . . . . . . . . . . . . 36.1 tt0 -60.51 -47.15 87.42 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 124.58 1.152 . . . . 0.0 108.833 179.097 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 31.7 m -60.89 -55.15 36.37 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 124.167 0.987 . . . . 0.0 110.428 179.484 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 96.7 mt -62.21 -30.83 49.73 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.48 0 C-N-CA 126.132 1.773 . . . . 0.0 110.641 -178.654 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 9.6 ttt85 -67.58 -43.82 79.64 Favored 'General case' 0 C--N 1.327 -0.395 0 O-C-N 120.515 -1.366 . . . . 0.0 110.104 179.437 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 1.2 mptm? -78.47 -44.46 24.53 Favored 'General case' 0 C--O 1.225 -0.214 0 CA-C-O 117.552 -1.213 . . . . 0.0 113.918 -178.07 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 34.9 tptt -62.64 -39.68 94.61 Favored 'General case' 0 N--CA 1.462 0.166 0 CA-C-N 119.966 1.257 . . . . 0.0 110.615 -178.109 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 34' ' ' ALA . . . . . . . . . . . . . . . -58.73 -55.74 31.17 Favored 'General case' 0 N--CA 1.448 -0.539 0 C-N-CA 124.839 1.256 . . . . 0.0 109.019 179.072 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 16.8 tt0 -65.46 -34.89 79.35 Favored 'General case' 0 N--CA 1.453 -0.316 0 CA-C-N 115.37 -0.832 . . . . 0.0 113.027 -178.321 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 36' ' ' ASP . . . . . . . . . . . . . 18.3 t70 -64.86 -40.85 95.79 Favored 'General case' 0 C--O 1.235 0.334 0 N-CA-C 107.929 -1.137 . . . . 0.0 107.929 178.361 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 37' ' ' SER . . . . . . . . . . . . . 6.9 t -77.75 -7.17 56.17 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 124.887 1.275 . . . . 0.0 110.671 178.821 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 72.7 2.54 56.7 Favored Glycine 0 CA--C 1.534 1.265 0 C-N-CA 125.032 1.301 . . . . 0.0 112.257 -179.068 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 39' ' ' LEU . . . . . . . . . . . . . 11.2 mt -99.6 106.31 18.27 Favored 'General case' 0 N--CA 1.447 -0.6 0 C-N-CA 125.952 1.701 . . . . 0.0 107.294 -179.52 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 40' ' ' THR . . . . . . . . . . . . . 8.8 t -45.27 150.83 0.4 Allowed 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 124.947 1.299 . . . . 0.0 109.67 179.016 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 41' ' ' VAL . . . . . . . . . . . . . 65.4 t -43.46 -44.64 1.61 Allowed 'Isoleucine or valine' 0 N--CA 1.461 0.096 0 C-N-CA 125.85 1.66 . . . . 0.0 112.473 -177.705 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 42' ' ' SER . . . . . . . . . . . . . 1.4 p -61.41 -46.75 88.84 Favored 'General case' 0 CA--C 1.538 0.489 0 CA-C-N 119.518 1.053 . . . . 0.0 111.615 179.896 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -66.52 -39.03 88.41 Favored 'General case' 0 C--O 1.225 -0.2 0 C-N-CA 123.251 0.621 . . . . 0.0 109.566 178.557 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 44' ' ' TYR . . . . . . . . . . . . . 61.7 t80 -58.82 -52.85 63.96 Favored 'General case' 0 C--O 1.221 -0.413 0 N-CA-C 108.495 -0.928 . . . . 0.0 108.495 179.134 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 45' ' ' ILE . . . . . . . . . . . . . 21.2 mm -53.45 -61.63 0.84 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.196 0 C-N-CA 124.173 0.989 . . . . 0.0 109.577 179.819 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 46' ' ' ARG . . . . . . . . . . . . . 18.4 ptt180 -52.0 -47.51 64.88 Favored 'General case' 0 CA--C 1.53 0.194 0 N-CA-C 112.704 0.631 . . . . 0.0 112.704 -179.012 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 47' ' ' ASN . . . . . . . . . . . . . 32.6 t30 -66.05 -52.44 48.96 Favored 'General case' 0 C--N 1.329 -0.322 0 C-N-CA 125.37 1.468 . . . . 0.0 112.987 -179.352 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -61.84 -33.26 73.84 Favored 'General case' 0 C--O 1.223 -0.333 0 C-N-CA 125.293 1.437 . . . . 0.0 110.976 -179.594 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 49' ' ' ALA . . . . . . . . . . . . . . . -66.71 -55.57 14.51 Favored 'General case' 0 N--CA 1.444 -0.762 0 C-N-CA 122.41 0.284 . . . . 0.0 111.02 -179.77 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 14.8 mt -69.62 -40.19 76.74 Favored 'General case' 0 CA--C 1.516 -0.341 0 N-CA-C 115.562 1.69 . . . . 0.0 115.562 -177.327 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 51' ' ' ASN . . . . . . . . . . . . . 57.0 m-80 . . . . . 0 C--O 1.251 1.153 0 CA-C-O 118.321 -0.847 . . . . 0.0 111.165 -176.774 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 11.8 t . . . . . 0 N--CA 1.437 -1.1 0 N-CA-C 107.844 -1.169 . . . . 0.0 107.844 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 95.9 t -97.28 154.64 3.69 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.879 0 N-CA-C 104.457 -2.423 . . . . 0.0 104.457 177.835 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 8.3 p -144.09 101.85 0.7 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.532 0 N-CA-C 105.598 -2.001 . . . . 0.0 105.598 178.68 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 10.6 ttm180 -144.09 172.7 12.53 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 107.843 -1.169 . . . . 0.0 107.843 179.392 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -121.59 136.87 54.93 Favored 'General case' 0 C--N 1.321 -0.637 0 C-N-CA 127.217 2.207 . . . . 0.0 107.597 -179.567 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 74.0 mt -120.84 170.8 9.13 Favored 'General case' 0 C--O 1.236 0.39 0 N-CA-C 107.464 -1.309 . . . . 0.0 107.464 178.547 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 23.4 mmt-85 -128.77 151.16 49.88 Favored 'General case' 0 C--N 1.327 -0.412 0 C-N-CA 124.978 1.311 . . . . 0.0 107.967 179.639 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 98.5 m-85 -147.87 140.91 24.95 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 106.429 -1.693 . . . . 0.0 106.429 179.588 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 1.5 m -68.96 172.14 5.37 Favored Pre-proline 0 CA--C 1.545 0.755 0 C-N-CA 124.26 1.024 . . . . 0.0 108.664 179.381 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 59.4 Cg_endo -67.72 -38.28 14.21 Favored 'Trans proline' 0 N--CA 1.458 -0.609 0 CA-C-N 121.271 1.49 . . . . 0.0 111.351 -179.067 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 21.3 t -72.46 -36.38 54.34 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.488 0 C-N-CA 123.105 0.562 . . . . 0.0 109.796 179.632 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -67.85 -42.66 81.03 Favored 'General case' 0 C--O 1.225 -0.224 0 N-CA-C 108.724 -0.843 . . . . 0.0 108.724 179.377 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 26.5 t70 -65.4 -46.02 81.68 Favored 'General case' 0 C--O 1.224 -0.286 0 N-CA-C 108.915 -0.772 . . . . 0.0 108.915 178.763 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 63.9 tt0 -54.74 -48.57 72.4 Favored 'General case' 0 N--CA 1.452 -0.367 0 C-N-CA 125.112 1.365 . . . . 0.0 108.052 178.23 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 46.1 m -67.51 -51.31 52.6 Favored 'General case' 0 C--O 1.222 -0.388 0 C-N-CA 124.149 0.98 . . . . 0.0 111.3 -179.441 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 59.6 mt -60.25 -31.96 49.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 O-C-N 120.52 -1.363 . . . . 0.0 110.109 -179.436 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 31.9 ttt180 -76.24 -45.14 34.31 Favored 'General case' 0 CA--C 1.511 -0.545 0 N-CA-C 109.318 -0.623 . . . . 0.0 109.318 -179.151 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . 0.391 0.0 OUTLIER -66.04 -30.64 71.21 Favored 'General case' 0 N--CA 1.45 -0.447 0 O-C-N 123.277 0.361 . . . . 0.0 110.259 -179.856 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 7.4 mmmm -77.48 -48.91 15.92 Favored 'General case' 0 C--O 1.222 -0.362 0 N-CA-C 107.346 -1.353 . . . . 0.0 107.346 178.178 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -54.4 -57.14 12.45 Favored 'General case' 0 C--N 1.339 0.112 0 C-N-CA 124.083 0.953 . . . . 0.0 110.278 -179.803 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 7.5 tp10 -62.96 -41.26 99.47 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-O 118.881 -0.581 . . . . 0.0 111.845 -179.059 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 37.0 t70 -66.36 -26.84 67.46 Favored 'General case' 0 N--CA 1.47 0.571 0 CA-C-N 119.435 1.016 . . . . 0.0 110.724 179.771 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 1.7 t -89.81 -2.28 58.18 Favored 'General case' 0 N--CA 1.447 -0.625 0 C-N-CA 124.533 1.133 . . . . 0.0 110.119 178.861 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 65.23 33.97 88.29 Favored Glycine 0 CA--C 1.526 0.77 0 CA-C-O 118.835 -0.98 . . . . 0.0 112.569 179.627 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 81.0 mt -128.29 152.58 47.96 Favored 'General case' 0 C--O 1.233 0.23 0 C-N-CA 125.502 1.521 . . . . 0.0 108.589 179.924 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -76.71 148.48 36.75 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 104.24 -2.504 . . . . 0.0 104.24 177.183 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 20.1 t -50.35 -39.78 17.35 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.539 0 C-N-CA 124.683 1.193 . . . . 0.0 109.477 177.844 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 66.2 p -58.75 -48.14 82.24 Favored 'General case' 0 CA--C 1.539 0.555 0 O-C-N 121.105 -0.997 . . . . 0.0 111.777 179.47 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -67.6 -46.44 72.58 Favored 'General case' 0 C--O 1.221 -0.403 0 C-N-CA 125.09 1.356 . . . . 0.0 108.581 179.053 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 55.0 t80 -52.66 -53.66 44.09 Favored 'General case' 0 N--CA 1.451 -0.379 0 C-N-CA 124.703 1.201 . . . . 0.0 109.487 179.959 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 18.4 mm -51.94 -62.11 0.63 Allowed 'Isoleucine or valine' 0 C--N 1.341 0.218 0 C-N-CA 124.575 1.15 . . . . 0.0 111.258 -179.784 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 12.7 ptm180 -60.92 -46.28 91.31 Favored 'General case' 0 C--O 1.222 -0.374 0 CA-C-O 118.687 -0.673 . . . . 0.0 111.687 -178.682 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 10.7 t30 -51.96 -55.22 21.7 Favored 'General case' 0 C--N 1.332 -0.184 0 C-N-CA 124.405 1.082 . . . . 0.0 110.089 -179.443 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -66.18 -29.83 70.18 Favored 'General case' 0 N--CA 1.453 -0.298 0 C-N-CA 124.99 1.316 . . . . 0.0 113.149 179.924 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -81.38 -19.8 41.9 Favored 'General case' 0 N--CA 1.462 0.151 0 N-CA-C 113.362 0.875 . . . . 0.0 113.362 -179.303 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 23.4 mt -106.19 -36.98 6.73 Favored 'General case' 0 CA--C 1.516 -0.332 0 N-CA-C 114.015 1.117 . . . . 0.0 114.015 -178.533 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 12.7 m-80 . . . . . 0 C--O 1.248 1.015 0 CA-C-O 117.805 -1.093 . . . . 0.0 110.972 -176.975 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 14.3 t . . . . . 0 N--CA 1.44 -0.955 0 N-CA-C 106.634 -1.617 . . . . 0.0 106.634 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 5.4 t -109.8 156.97 10.47 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.574 0 N-CA-C 106.515 -1.661 . . . . 0.0 106.515 177.909 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 11.5 p -137.69 113.67 11.06 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.681 0 N-CA-C 105.182 -2.155 . . . . 0.0 105.182 176.939 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 34.5 ttm-85 -145.19 149.11 34.37 Favored 'General case' 0 CA--C 1.514 -0.422 0 CA-C-O 121.059 0.457 . . . . 0.0 109.8 178.936 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -93.85 132.77 37.93 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 107.402 -1.333 . . . . 0.0 107.402 -179.482 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 69.9 mt -129.49 151.96 49.54 Favored 'General case' 0 C--O 1.239 0.542 0 N-CA-C 107.532 -1.284 . . . . 0.0 107.532 178.747 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 22.0 mmt85 -112.6 151.19 30.37 Favored 'General case' 0 C--N 1.323 -0.571 0 C-N-CA 127.977 2.511 . . . . 0.0 108.234 -179.798 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 22' ' ' PHE . . . . . . . . . . . . . 89.7 m-85 -148.73 139.43 22.78 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 104.829 -2.285 . . . . 0.0 104.829 178.769 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 4.7 m -70.57 168.54 18.97 Favored Pre-proline 0 CA--C 1.551 1.012 0 N-CA-C 108.279 -1.008 . . . . 0.0 108.279 179.408 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 24' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -66.14 -40.88 14.33 Favored 'Trans proline' 0 N--CA 1.46 -0.456 0 C-N-CA 122.475 2.117 . . . . 0.0 114.178 -177.363 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 25' ' ' VAL . . . . . . . . . . . . . 77.1 t -66.81 -45.62 87.31 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.305 0 C-N-CA 123.94 0.896 . . . . 0.0 109.51 -179.709 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -68.08 -38.85 82.84 Favored 'General case' 0 N--CA 1.453 -0.297 0 C-N-CA 124.68 1.192 . . . . 0.0 110.983 -178.495 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 27' ' ' ASP . . . . . . . . . . . . . 10.1 t70 -64.59 -44.1 91.7 Favored 'General case' 0 N--CA 1.454 -0.264 0 C-N-CA 123.102 0.561 . . . . 0.0 109.998 178.473 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 28' ' ' GLU . . . . . . . . . . . . . 26.5 tt0 -62.16 -45.75 92.02 Favored 'General case' 0 N--CA 1.449 -0.514 0 N-CA-C 108.105 -1.072 . . . . 0.0 108.105 179.556 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 31.0 m -56.06 -52.91 62.56 Favored 'General case' 0 C--N 1.341 0.199 0 N-CA-C 108.512 -0.921 . . . . 0.0 108.512 178.699 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 84.4 mt -58.0 -41.17 79.66 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.3 0 C-N-CA 122.66 0.384 . . . . 0.0 110.099 -179.717 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 37.4 ttt-85 -61.42 -47.43 85.81 Favored 'General case' 0 C--O 1.23 0.067 0 O-C-N 121.45 -0.781 . . . . 0.0 110.62 -179.647 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 2.6 mptm? -65.48 -46.83 78.2 Favored 'General case' 0 CA--C 1.523 -0.083 0 C-N-CA 123.008 0.523 . . . . 0.0 110.473 -179.593 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 9.1 mmmm -59.46 -48.31 82.13 Favored 'General case' 0 CA--C 1.527 0.065 0 N-CA-C 109.272 -0.64 . . . . 0.0 109.272 -179.655 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 34' ' ' ALA . . . . . . . . . . . . . . . -59.43 -49.77 76.52 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 124.768 1.227 . . . . 0.0 112.156 -179.821 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 5.4 tp10 -56.0 -49.69 72.94 Favored 'General case' 0 C--O 1.233 0.186 0 C-N-CA 124.414 1.086 . . . . 0.0 110.696 -179.495 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 36' ' ' ASP . . . . . . . . . . . . . 6.8 t70 -67.89 -44.05 77.88 Favored 'General case' 0 N--CA 1.454 -0.262 0 C-N-CA 124.107 0.963 . . . . 0.0 111.875 -178.927 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 37' ' ' SER . . . . . . . . . . . . . 30.4 t -66.24 -18.77 65.56 Favored 'General case' 0 N--CA 1.448 -0.556 0 C-N-CA 124.403 1.081 . . . . 0.0 110.943 -179.453 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 73.47 20.35 79.84 Favored Glycine 0 CA--C 1.528 0.893 0 N-CA-C 110.632 -0.987 . . . . 0.0 110.632 -179.189 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 39' ' ' LEU . . . . . . . . . . . . . 81.4 mt -120.45 107.81 13.34 Favored 'General case' 0 N--CA 1.447 -0.576 0 N-CA-C 103.121 -2.918 . . . . 0.0 103.121 179.56 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 40' ' ' THR . . . . . . . . . . . . . 13.8 t -50.76 156.3 0.98 Allowed 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 123.342 0.657 . . . . 0.0 109.502 -179.776 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 41' ' ' VAL . . . . . . . . . . . . . 80.8 t -44.99 -43.97 2.72 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.418 0 C-N-CA 125.019 1.328 . . . . 0.0 112.804 -177.74 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 42' ' ' SER . . . . . . . . . . . . . 9.8 p -65.48 -42.77 91.85 Favored 'General case' 0 CA--C 1.542 0.642 0 CA-C-N 119.256 0.935 . . . . 0.0 112.276 179.474 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -66.31 -45.39 80.53 Favored 'General case' 0 C--O 1.226 -0.183 0 C-N-CA 125.545 1.538 . . . . 0.0 108.921 178.941 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 44' ' ' TYR . . . . . . . . . . . . . 72.3 t80 -56.25 -51.31 68.6 Favored 'General case' 0 N--CA 1.443 -0.781 0 C-N-CA 125.685 1.594 . . . . 0.0 109.256 179.627 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 45' ' ' ILE . . . . . . . . . . . . . 9.0 mm -56.12 -58.94 3.41 Favored 'Isoleucine or valine' 0 C--N 1.34 0.162 0 C-N-CA 123.427 0.691 . . . . 0.0 110.952 179.561 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 46' ' ' ARG . . . . . . . . . . . . . 13.3 ptm180 -57.52 -48.97 77.84 Favored 'General case' 0 C--O 1.221 -0.426 0 CA-C-O 118.213 -0.898 . . . . 0.0 111.113 -178.832 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 47' ' ' ASN . . . . . . . . . . . . . 20.1 t30 -55.4 -55.94 25.89 Favored 'General case' 0 N--CA 1.452 -0.349 0 CA-C-N 118.935 0.789 . . . . 0.0 110.837 -179.493 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -59.9 -26.8 66.2 Favored 'General case' 0 CA--C 1.531 0.245 0 C-N-CA 123.529 0.732 . . . . 0.0 112.816 -179.486 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 49' ' ' ALA . . . . . . . . . . . . . . . -84.29 -12.48 54.59 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 124.176 0.991 . . . . 0.0 113.073 179.746 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 14.2 mt -109.99 -30.06 7.96 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 118.856 0.753 . . . . 0.0 111.481 179.749 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 51' ' ' ASN . . . . . . . . . . . . . 11.8 m-80 . . . . . 0 C--O 1.249 1.048 0 C-N-CA 126.057 1.743 . . . . 0.0 109.805 -178.815 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 3.4 p . . . . . 0 N--CA 1.469 0.488 0 CA-C-O 120.729 0.3 . . . . 0.0 111.204 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -156.47 177.45 11.45 Favored 'General case' 0 C--O 1.234 0.267 0 C-N-CA 125.084 1.354 . . . . 0.0 107.968 178.849 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 5.7 m -150.51 168.87 22.94 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 106.999 -1.482 . . . . 0.0 106.999 178.47 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -55.62 -71.34 0.09 Allowed 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 123.355 0.662 . . . . 0.0 110.62 -179.916 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 27.6 m -76.28 7.26 0.71 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.694 0 C-N-CA 124.783 1.233 . . . . 0.0 113.582 -179.656 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 49.8 mtt180 -141.52 80.0 1.71 Allowed 'General case' 0 N--CA 1.465 0.303 0 O-C-N 120.211 -1.556 . . . . 0.0 108.553 179.772 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 1.5 ttmp? -130.35 24.32 5.17 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 124.542 1.137 . . . . 0.0 110.531 -179.785 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.59 8.6 0.81 Allowed 'General case' 0 CA--C 1.539 0.549 0 O-C-N 120.772 -1.205 . . . . 0.0 113.029 179.375 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -62.71 -56.45 17.54 Favored 'General case' 0 N--CA 1.449 -0.486 0 C-N-CA 126.043 1.737 . . . . 0.0 110.495 179.454 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 20.3 tt0 -158.84 164.2 35.95 Favored 'General case' 0 C--O 1.237 0.399 0 C-N-CA 124.825 1.25 . . . . 0.0 109.223 -179.439 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 20.1 t -133.84 -89.43 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.451 -0.414 0 C-N-CA 126.02 1.728 . . . . 0.0 106.509 178.902 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 8.0 ptm180 -157.7 161.3 38.54 Favored 'General case' 0 C--O 1.238 0.45 0 C-N-CA 127.942 2.497 . . . . 0.0 107.343 -179.531 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 28.3 mm-40 -78.82 91.81 4.78 Favored 'General case' 0 C--N 1.332 -0.182 0 N-CA-C 106.302 -1.74 . . . . 0.0 106.302 178.772 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 18.7 ptmt -57.49 -47.36 82.1 Favored 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 123.959 0.904 . . . . 0.0 108.886 179.211 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 8.4 t -79.34 155.8 28.28 Favored 'General case' 0 N--CA 1.434 -1.254 0 N-CA-C 108.59 -0.893 . . . . 0.0 108.59 179.467 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 2.5 t -103.92 134.34 45.44 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.801 0 N-CA-C 104.763 -2.31 . . . . 0.0 104.763 178.344 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 8.8 p -127.32 111.63 25.87 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 N-CA-C 106.295 -1.743 . . . . 0.0 106.295 179.102 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 61.6 ttm-85 -141.68 157.7 44.74 Favored 'General case' 0 CA--C 1.52 -0.206 0 CA-C-N 115.447 -0.797 . . . . 0.0 108.972 -179.807 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 45.0 m -95.7 110.03 22.23 Favored 'General case' 0 N--CA 1.448 -0.544 0 N-CA-C 104.62 -2.363 . . . . 0.0 104.62 178.674 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 12.6 tp -104.24 145.9 29.56 Favored 'General case' 0 C--O 1.237 0.428 0 N-CA-C 106.839 -1.541 . . . . 0.0 106.839 179.841 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 33.1 mtt180 -127.74 161.3 29.28 Favored 'General case' 0 N--CA 1.453 -0.298 0 C-N-CA 123.529 0.732 . . . . 0.0 110.306 -179.538 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 95.1 m-85 -149.49 159.03 44.65 Favored 'General case' 0 N--CA 1.465 0.298 0 C-N-CA 124.311 1.045 . . . . 0.0 108.818 -179.117 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -84.91 169.87 15.15 Favored Pre-proline 0 CA--C 1.542 0.658 0 N-CA-C 108.477 -0.935 . . . . 0.0 108.477 178.578 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -61.49 -32.64 88.5 Favored 'Trans proline' 0 C--N 1.349 0.602 0 C-N-CA 122.04 1.827 . . . . 0.0 111.811 -178.834 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 93.4 t -66.23 -58.38 6.86 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.419 0 C-N-CA 125.885 1.674 . . . . 0.0 108.511 179.526 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -56.66 -40.15 74.99 Favored 'General case' 0 CA--C 1.521 -0.148 0 CA-C-N 118.146 0.43 . . . . 0.0 111.389 -179.722 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 32.8 t70 -65.49 -42.68 91.89 Favored 'General case' 0 CA--C 1.512 -0.483 0 C-N-CA 123.989 0.916 . . . . 0.0 110.994 179.647 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 34.9 tt0 -60.28 -52.64 64.43 Favored 'General case' 0 N--CA 1.448 -0.56 0 N-CA-C 107.738 -1.208 . . . . 0.0 107.738 179.328 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 57.0 m -56.41 -56.46 20.92 Favored 'General case' 0 N--CA 1.451 -0.385 0 C-N-CA 123.046 0.538 . . . . 0.0 110.161 -179.194 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 27.8 mt -58.82 -43.38 88.02 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.536 0 N-CA-C 112.412 0.523 . . . . 0.0 112.412 -178.576 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 31.6 ttt180 -59.14 -47.0 86.9 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 118.616 0.644 . . . . 0.0 109.814 179.63 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 2.3 mptm? -66.72 -40.89 88.57 Favored 'General case' 0 CA--C 1.529 0.153 0 CA-C-O 119.456 -0.307 . . . . 0.0 110.248 -179.726 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 8.4 tptt -64.73 -44.41 90.26 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-N 118.994 0.815 . . . . 0.0 111.118 -179.361 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -61.55 -53.16 59.96 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 124.377 1.071 . . . . 0.0 111.12 -179.856 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 3.7 tp10 -65.18 -36.18 83.39 Favored 'General case' 0 C--O 1.233 0.227 0 N-CA-C 113.419 0.896 . . . . 0.0 113.419 -177.137 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 30.3 t70 -67.83 -40.88 83.73 Favored 'General case' 0 CA--C 1.517 -0.322 0 N-CA-C 109.894 -0.41 . . . . 0.0 109.894 179.112 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 9.4 t -75.7 -14.05 60.33 Favored 'General case' 0 N--CA 1.452 -0.326 0 CA-C-N 115.784 -0.643 . . . . 0.0 111.68 -179.337 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 71.92 39.89 58.39 Favored Glycine 0 CA--C 1.526 0.733 0 N-CA-C 108.955 -1.658 . . . . 0.0 108.955 -178.876 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 84.2 mt -128.32 137.1 51.79 Favored 'General case' 0 N--CA 1.448 -0.552 0 N-CA-C 103.109 -2.922 . . . . 0.0 103.109 179.021 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 5.7 t -70.6 155.67 40.44 Favored 'General case' 0 C--N 1.319 -0.728 0 N-CA-C 106.053 -1.832 . . . . 0.0 106.053 178.226 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 74.3 t -52.73 -40.93 36.79 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.452 0 O-C-N 121.033 -1.042 . . . . 0.0 111.988 -179.601 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 65.3 p -61.97 -46.85 87.44 Favored 'General case' 0 N--CA 1.468 0.431 0 CA-C-N 119.494 1.043 . . . . 0.0 110.921 -179.855 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.88 -45.04 91.16 Favored 'General case' 0 C--O 1.219 -0.51 0 N-CA-C 108.238 -1.023 . . . . 0.0 108.238 178.311 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 92.5 t80 -54.35 -48.85 70.96 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 123.806 0.842 . . . . 0.0 109.928 -179.835 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 5.1 mm -56.45 -65.32 0.4 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.241 0 C-N-CA 125.051 1.34 . . . . 0.0 110.88 179.667 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 10.6 ptt180 -57.53 -39.96 77.74 Favored 'General case' 0 C--O 1.22 -0.463 0 CA-C-O 118.898 -0.572 . . . . 0.0 110.442 -178.833 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 8.9 t30 -58.31 -56.98 15.09 Favored 'General case' 0 N--CA 1.453 -0.277 0 C-N-CA 124.07 0.948 . . . . 0.0 109.298 179.432 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -60.11 -34.2 73.17 Favored 'General case' 0 CA--C 1.532 0.264 0 CA-C-O 121.362 0.601 . . . . 0.0 111.132 -179.797 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -67.74 -26.84 66.34 Favored 'General case' 0 CA--C 1.538 0.508 0 O-C-N 121.283 -0.886 . . . . 0.0 113.187 -179.885 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 6.1 mt -100.4 -31.59 11.24 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-N 119.32 0.964 . . . . 0.0 112.069 -178.652 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 38.4 m-80 . . . . . 0 C--O 1.247 0.958 0 C-N-CA 124.712 1.205 . . . . 0.0 108.134 179.583 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 1' ' ' SER . . . . . . . . . . . . . 2.9 p . . . . . 0 N--CA 1.472 0.657 0 N-CA-C 109.651 -0.5 . . . . 0.0 109.651 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 2' ' ' ASP . . . . . . . . . . . . . 2.6 p-10 -164.15 -172.91 2.94 Favored 'General case' 0 N--CA 1.464 0.254 0 O-C-N 121.144 -0.972 . . . . 0.0 109.671 -179.532 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 3' ' ' SER . . . . . . . . . . . . . 58.6 m -158.09 154.66 27.89 Favored 'General case' 0 N--CA 1.448 -0.574 0 C-N-CA 127.62 2.368 . . . . 0.0 104.974 177.472 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 4' ' ' ALA . . . . . . . . . . . . . . . -53.31 -37.83 62.6 Favored 'General case' 0 CA--C 1.537 0.454 0 N-CA-C 112.727 0.64 . . . . 0.0 112.727 -179.525 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 9.8 p -103.98 3.51 10.58 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.721 0 C-N-CA 124.382 1.073 . . . . 0.0 112.489 -179.517 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 6' ' ' ARG . . . . . . . . . . . . . 33.9 mtt180 -131.88 68.94 1.48 Allowed 'General case' 0 N--CA 1.467 0.403 0 O-C-N 119.977 -1.702 . . . . 0.0 108.673 179.998 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 4.1 ttmp? -136.53 78.58 1.71 Allowed 'General case' 0 N--CA 1.45 -0.463 0 N-CA-C 105.734 -1.95 . . . . 0.0 105.734 178.907 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 6.3 mptt -125.04 6.25 7.93 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 125.705 1.602 . . . . 0.0 109.43 179.122 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 1.8 p -60.55 -64.86 0.8 Allowed 'General case' 0 N--CA 1.449 -0.479 0 C-N-CA 125.382 1.473 . . . . 0.0 109.951 -179.328 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 10' ' ' GLU . . . . . . . . . . . . . 7.9 tt0 -155.79 83.64 1.02 Allowed 'General case' 0 CA--C 1.534 0.349 0 N-CA-C 108.772 -0.825 . . . . 0.0 108.772 179.975 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 11' ' ' VAL . . . . . . . . . . . . . 60.1 t -62.19 -62.77 1.0 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.362 0 C-N-CA 123.337 0.655 . . . . 0.0 109.616 179.759 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 12' ' ' ARG . . . . . . . . . . . . . 26.6 ttm180 -170.26 147.32 3.08 Favored 'General case' 0 C--O 1.239 0.518 0 C-N-CA 126.279 1.831 . . . . 0.0 107.398 179.889 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 13' ' ' GLN . . . . . . . . . . . . . 58.0 mm-40 -78.34 94.25 4.81 Favored 'General case' 0 CA--C 1.516 -0.359 0 N-CA-C 103.791 -2.67 . . . . 0.0 103.791 177.727 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 40.7 pttt -68.83 -34.86 76.2 Favored 'General case' 0 N--CA 1.449 -0.514 0 N-CA-C 108.253 -1.017 . . . . 0.0 108.253 178.925 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 6.0 t -74.65 154.38 38.52 Favored 'General case' 0 N--CA 1.437 -1.09 0 N-CA-C 107.066 -1.457 . . . . 0.0 107.066 178.09 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 2.4 t -101.07 154.39 4.68 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.911 0 N-CA-C 103.77 -2.678 . . . . 0.0 103.77 177.278 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 11.2 p -145.81 115.39 1.56 Allowed 'Isoleucine or valine' 0 N--CA 1.444 -0.73 0 N-CA-C 106.524 -1.658 . . . . 0.0 106.524 179.468 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 49.0 ttm-85 -152.96 161.19 42.84 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.615 0.721 . . . . 0.0 110.721 -179.63 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -96.92 110.88 23.3 Favored 'General case' 0 N--CA 1.446 -0.646 0 N-CA-C 105.484 -2.043 . . . . 0.0 105.484 179.219 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -109.17 108.89 19.7 Favored 'General case' 0 C--O 1.236 0.357 0 N-CA-C 106.537 -1.653 . . . . 0.0 106.537 -179.887 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 5.7 mtp180 -87.37 153.28 21.57 Favored 'General case' 0 C--N 1.334 -0.065 0 C-N-CA 122.73 0.412 . . . . 0.0 110.254 -179.916 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 22' ' ' PHE . . . . . . . . . . . . . 87.7 m-85 -141.2 143.77 34.39 Favored 'General case' 0 N--CA 1.468 0.471 0 N-CA-C 107.97 -1.122 . . . . 0.0 107.97 179.921 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 1.2 m -74.1 167.03 39.41 Favored Pre-proline 0 CA--C 1.538 0.499 0 CA-C-O 118.254 -0.879 . . . . 0.0 108.986 179.882 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 24' ' ' PRO . . . . . . . . . . . . . 61.0 Cg_endo -67.97 -33.2 26.71 Favored 'Trans proline' 0 C--N 1.346 0.427 0 C-N-CA 121.91 1.74 . . . . 0.0 112.283 -179.181 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 25' ' ' VAL . . . . . . . . . . . . . 61.9 t -64.8 -52.02 59.61 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.413 0 N-CA-C 107.847 -1.168 . . . . 0.0 107.847 179.637 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 1.4 mp0 -63.32 -44.55 94.62 Favored 'General case' 0 C--O 1.222 -0.368 0 C-N-CA 124.156 0.982 . . . . 0.0 110.477 179.276 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 27' ' ' ASP . . . . . . . . . . . . . 6.7 t70 -57.13 -45.22 83.67 Favored 'General case' 0 C--O 1.223 -0.298 0 C-N-CA 125.714 1.606 . . . . 0.0 111.446 -179.685 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 28' ' ' GLU . . . . . . . . . . . . . 46.3 tt0 -63.42 -46.52 85.98 Favored 'General case' 0 N--CA 1.448 -0.549 0 N-CA-C 108.614 -0.884 . . . . 0.0 108.614 178.866 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 52.0 m -62.27 -47.87 82.43 Favored 'General case' 0 C--N 1.333 -0.11 0 O-C-N 121.695 -0.628 . . . . 0.0 110.524 179.226 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 79.2 mt -63.37 -38.4 82.07 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.634 0 CA-C-O 122.415 1.102 . . . . 0.0 108.399 179.759 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 70.0 ttt180 -64.66 -38.3 90.52 Favored 'General case' 0 C--N 1.327 -0.378 0 O-C-N 118.881 -2.387 . . . . 0.0 109.29 178.226 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -71.8 -48.22 47.94 Favored 'General case' 0 C--N 1.33 -0.262 0 C-N-CA 123.937 0.895 . . . . 0.0 112.462 -179.151 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 12.7 mptt -66.45 -46.11 77.53 Favored 'General case' 0 C--O 1.225 -0.221 0 CA-C-O 118.026 -0.988 . . . . 0.0 108.604 -179.857 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 34' ' ' ALA . . . . . . . . . . . . . . . -53.7 -56.31 18.45 Favored 'General case' 0 CA--C 1.528 0.123 0 CA-C-N 119.317 0.962 . . . . 0.0 110.183 179.284 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 5.2 tp10 -63.17 -39.28 94.19 Favored 'General case' 0 C--O 1.232 0.153 0 N-CA-C 112.578 0.585 . . . . 0.0 112.578 -178.303 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 36' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -69.3 -35.57 76.12 Favored 'General case' 0 N--CA 1.46 0.055 0 CA-C-N 118.453 0.57 . . . . 0.0 110.355 179.622 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 37' ' ' SER . . . . . . . . . . . . . 13.9 t -75.92 -12.14 60.09 Favored 'General case' 0 CA--C 1.541 0.628 0 N-CA-C 108.911 -0.774 . . . . 0.0 108.911 178.234 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 75.44 29.6 59.68 Favored Glycine 0 C--N 1.339 0.696 0 O-C-N 121.126 -0.984 . . . . 0.0 110.74 -179.504 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 39' ' ' LEU . . . . . . . . . . . . . 87.6 mt -120.9 159.05 26.32 Favored 'General case' 0 N--CA 1.445 -0.71 0 C-N-CA 125.469 1.508 . . . . 0.0 107.929 179.425 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 40' ' ' THR . . . . . 0.495 HG23 ' H ' ' B' ' 43' ' ' ALA . 1.6 t -81.39 151.9 27.71 Favored 'General case' 0 C--N 1.322 -0.609 0 N-CA-C 104.109 -2.552 . . . . 0.0 104.109 176.799 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 41' ' ' VAL . . . . . . . . . . . . . 42.2 t -48.17 -42.09 10.73 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.659 0 C-N-CA 125.217 1.407 . . . . 0.0 109.627 178.516 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 42' ' ' SER . . . . . . . . . . . . . 13.2 p -60.37 -51.08 71.04 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-N 119.648 1.113 . . . . 0.0 111.39 179.465 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 43' ' ' ALA . . . . . 0.495 ' H ' HG23 ' B' ' 40' ' ' THR . . . -61.04 -42.85 99.25 Favored 'General case' 0 C--O 1.223 -0.302 0 C-N-CA 123.601 0.761 . . . . 0.0 109.023 179.193 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 44' ' ' TYR . . . . . . . . . . . . . 46.8 t80 -58.39 -50.63 72.98 Favored 'General case' 0 N--CA 1.445 -0.709 0 N-CA-C 109.444 -0.576 . . . . 0.0 109.444 179.486 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 45' ' ' ILE . . . . . . . . . . . . . 22.7 mm -55.44 -61.03 1.21 Allowed 'Isoleucine or valine' 0 C--N 1.34 0.189 0 C-N-CA 124.036 0.934 . . . . 0.0 110.214 179.762 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 46' ' ' ARG . . . . . . . . . . . . . 26.9 ptt180 -53.92 -49.11 69.37 Favored 'General case' 0 C--O 1.223 -0.33 0 CA-C-O 118.967 -0.54 . . . . 0.0 111.384 -178.566 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 47' ' ' ASN . . . . . . . . . . . . . 24.0 t30 -60.34 -51.76 68.14 Favored 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 124.195 0.998 . . . . 0.0 112.692 -179.075 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -61.45 -35.57 77.97 Favored 'General case' 0 C--O 1.222 -0.344 0 O-C-N 123.82 0.7 . . . . 0.0 111.528 -179.858 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 49' ' ' ALA . . . . . . . . . . . . . . . -77.07 -24.25 51.92 Favored 'General case' 0 N--CA 1.447 -0.595 0 N-CA-C 113.575 0.954 . . . . 0.0 113.575 -178.79 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 24.8 mt -84.96 -40.75 16.58 Favored 'General case' 0 CA--C 1.513 -0.47 0 CA-C-N 118.734 0.697 . . . . 0.0 111.172 -179.671 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 51' ' ' ASN . . . . . . . . . . . . . 69.5 m-80 . . . . . 0 C--O 1.247 0.924 0 CA-C-O 116.301 -1.809 . . . . 0.0 108.952 179.808 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 1.4 m . . . . . 0 N--CA 1.467 0.395 0 N-CA-C 108.361 -0.977 . . . . 0.0 108.361 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 39.5 t0 -164.78 177.72 7.75 Favored 'General case' 0 CA--C 1.547 0.844 0 C-N-CA 131.31 3.844 . . . . 0.0 102.358 -179.448 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 50.4 m -147.51 119.9 8.43 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 119.367 -2.083 . . . . 0.0 106.426 -179.432 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -51.23 -30.11 16.42 Favored 'General case' 0 CA--C 1.536 0.428 0 N-CA-C 112.819 0.674 . . . . 0.0 112.819 -178.881 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 30.9 m -66.98 5.48 0.33 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.649 0 C-N-CA 126.267 1.827 . . . . 0.0 113.124 179.108 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 34.9 ttp85 -61.82 -7.8 4.09 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 125.317 1.447 . . . . 0.0 111.916 178.673 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -125.44 160.94 28.2 Favored 'General case' 0 C--O 1.234 0.245 0 C-N-CA 127.194 2.198 . . . . 0.0 106.148 177.612 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 29.7 pttt -141.99 110.92 6.25 Favored 'General case' 0 CA--C 1.52 -0.205 0 C-N-CA 123.178 0.591 . . . . 0.0 110.513 -179.121 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 9.1 p -80.08 -63.08 1.49 Allowed 'General case' 0 CA--C 1.532 0.27 0 N-CA-C 108.774 -0.824 . . . . 0.0 108.774 179.299 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 39.6 tt0 -61.44 149.28 39.06 Favored 'General case' 0 C--O 1.236 0.373 0 C-N-CA 125.018 1.327 . . . . 0.0 110.638 179.804 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 12.1 p -142.89 144.05 24.58 Favored 'Isoleucine or valine' 0 C--O 1.236 0.385 0 C-N-CA 126.274 1.829 . . . . 0.0 106.086 177.549 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -146.08 163.77 34.23 Favored 'General case' 0 CA--C 1.51 -0.562 0 N-CA-C 108.13 -1.063 . . . . 0.0 108.13 178.827 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 37.6 mm-40 -82.89 70.25 9.86 Favored 'General case' 0 CA--C 1.531 0.217 0 N-CA-C 107.005 -1.479 . . . . 0.0 107.005 178.936 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 16.0 ptmt -63.57 -38.64 91.9 Favored 'General case' 0 N--CA 1.457 -0.092 0 C-N-CA 127.384 2.274 . . . . 0.0 109.162 179.125 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 5.3 t -79.3 169.86 17.49 Favored 'General case' 0 N--CA 1.432 -1.364 0 C-N-CA 126.06 1.744 . . . . 0.0 108.457 179.163 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 16.0 t -101.77 157.61 4.46 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.578 0 N-CA-C 106.445 -1.687 . . . . 0.0 106.445 178.611 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 7.2 p -151.16 107.58 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 N-CA-C 105.723 -1.954 . . . . 0.0 105.723 178.05 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 4.2 ttt85 -152.66 146.63 25.31 Favored 'General case' 0 C--O 1.235 0.334 0 O-C-N 122.085 -0.385 . . . . 0.0 111.669 -178.954 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -76.97 119.03 20.14 Favored 'General case' 0 N--CA 1.449 -0.484 0 N-CA-C 104.739 -2.319 . . . . 0.0 104.739 177.212 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 13.0 tp -123.62 113.14 18.28 Favored 'General case' 0 N--CA 1.442 -0.835 0 C-N-CA 123.275 0.63 . . . . 0.0 109.371 179.788 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 7.7 mtm180 -98.31 162.24 13.28 Favored 'General case' 0 N--CA 1.453 -0.281 0 C-N-CA 125.629 1.572 . . . . 0.0 111.384 179.846 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 78.0 m-85 -144.24 150.99 38.81 Favored 'General case' 0 CA--C 1.53 0.208 0 C-N-CA 125.817 1.647 . . . . 0.0 107.004 179.421 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -75.26 175.43 4.08 Favored Pre-proline 0 CA--C 1.551 1.012 0 CA-C-N 119.83 1.195 . . . . 0.0 108.859 179.329 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . 0.491 ' HG3' ' HE3' ' B' ' 14' ' ' LYS . 43.6 Cg_endo -66.71 -43.38 7.43 Favored 'Trans proline' 0 C--N 1.35 0.634 0 CA-C-N 122.144 1.802 . . . . 0.0 113.067 -178.67 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 96.3 t -64.38 -41.71 93.17 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.218 0 N-CA-C 108.615 -0.883 . . . . 0.0 108.615 179.893 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -63.39 -47.75 80.73 Favored 'General case' 0 N--CA 1.452 -0.364 0 C-N-CA 123.664 0.785 . . . . 0.0 109.284 179.911 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 5.5 t70 -59.71 -49.91 75.91 Favored 'General case' 0 CA--C 1.507 -0.688 0 C-N-CA 125.837 1.655 . . . . 0.0 111.847 -179.898 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -62.29 -44.41 96.59 Favored 'General case' 0 N--CA 1.447 -0.613 0 N-CA-C 108.123 -1.066 . . . . 0.0 108.123 -179.64 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 30.8 m -61.17 -53.36 57.94 Favored 'General case' 0 N--CA 1.454 -0.265 0 N-CA-C 108.698 -0.852 . . . . 0.0 108.698 178.872 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 58.1 mt -58.16 -43.61 85.93 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.329 0 CA-C-N 119.038 0.835 . . . . 0.0 110.211 -179.644 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 23.2 ttt180 -63.22 -47.67 81.53 Favored 'General case' 0 C--N 1.332 -0.161 0 O-C-N 121.457 -0.777 . . . . 0.0 110.089 179.91 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 4.7 mptp? -63.71 -46.4 85.61 Favored 'General case' 0 C--O 1.225 -0.229 0 CA-C-N 118.82 0.736 . . . . 0.0 109.796 -179.786 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 13.5 mptt -64.82 -44.67 89.11 Favored 'General case' 0 CA--C 1.529 0.143 0 CA-C-O 118.057 -0.973 . . . . 0.0 110.237 -179.566 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -57.37 -56.14 25.67 Favored 'General case' 0 C--O 1.231 0.1 0 C-N-CA 124.656 1.183 . . . . 0.0 109.609 179.018 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 29.9 tt0 -60.63 -40.9 93.67 Favored 'General case' 0 N--CA 1.449 -0.488 0 C-N-CA 123.633 0.773 . . . . 0.0 112.132 -178.269 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 27.6 t70 -68.3 -30.27 69.22 Favored 'General case' 0 CA--C 1.53 0.173 0 C-N-CA 124.349 1.06 . . . . 0.0 110.138 179.449 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 10.1 t -82.18 -6.41 59.18 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 124.58 1.152 . . . . 0.0 109.375 178.153 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 69.2 29.27 72.12 Favored Glycine 0 CA--C 1.527 0.789 0 O-C-N 120.581 -1.325 . . . . 0.0 109.991 -179.265 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 75.9 mt -122.68 158.83 29.2 Favored 'General case' 0 N--CA 1.447 -0.597 0 C-N-CA 125.836 1.654 . . . . 0.0 108.137 179.99 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . 0.427 HG23 ' H ' ' A' ' 43' ' ' ALA . 0.7 OUTLIER -84.91 147.49 26.73 Favored 'General case' 0 C--N 1.32 -0.704 0 N-CA-C 104.036 -2.579 . . . . 0.0 104.036 177.235 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 39.8 t -46.8 -41.05 5.06 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.478 0 C-N-CA 125.356 1.463 . . . . 0.0 110.241 178.494 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -60.75 -49.44 77.48 Favored 'General case' 0 CA--C 1.548 0.873 0 CA-C-N 119.622 1.101 . . . . 0.0 110.587 179.515 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.427 ' H ' HG23 ' A' ' 40' ' ' THR . . . -64.47 -41.84 96.26 Favored 'General case' 0 C--O 1.224 -0.261 0 C-N-CA 125.229 1.411 . . . . 0.0 110.203 178.898 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 81.3 t80 -58.35 -52.54 65.19 Favored 'General case' 0 N--CA 1.452 -0.347 0 N-CA-C 108.087 -1.079 . . . . 0.0 108.087 179.256 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.461 HG23 HG23 ' B' ' 45' ' ' ILE . 16.6 mm -52.44 -59.8 1.4 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.298 0 C-N-CA 124.227 1.011 . . . . 0.0 110.698 179.499 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 29.5 ptt180 -59.05 -44.17 91.76 Favored 'General case' 0 C--O 1.222 -0.381 0 CA-C-O 118.72 -0.657 . . . . 0.0 112.304 -178.944 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 29.4 t30 -59.91 -52.35 65.8 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-N 118.657 0.662 . . . . 0.0 110.808 -178.922 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -62.99 -29.21 70.64 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 123.649 0.78 . . . . 0.0 111.502 179.438 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -80.5 -15.41 56.77 Favored 'General case' 0 CA--C 1.532 0.283 0 N-CA-C 113.791 1.034 . . . . 0.0 113.791 -179.677 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 31.0 mt -101.96 -42.89 5.95 Favored 'General case' 0 CA--C 1.522 -0.131 0 CA-C-N 120.173 1.351 . . . . 0.0 112.124 -179.606 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 60.8 m-80 . . . . . 0 C--O 1.245 0.836 0 O-C-N 124.159 0.912 . . . . 0.0 109.487 -179.437 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 1' ' ' SER . . . . . . . . . . . . . 8.7 m . . . . . 0 N--CA 1.467 0.386 0 N-CA-C 107.748 -1.205 . . . . 0.0 107.748 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 2' ' ' ASP . . . . . . . . . . . . . 1.8 p-10 -153.19 -143.07 0.12 Allowed 'General case' 0 CA--C 1.542 0.656 0 N-CA-C 104.769 -2.308 . . . . 0.0 104.769 179.605 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 3' ' ' SER . . . . . . . . . . . . . 16.7 m -151.85 120.4 6.46 Favored 'General case' 0 N--CA 1.45 -0.429 0 CA-C-N 121.404 1.911 . . . . 0.0 107.415 179.013 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 4' ' ' ALA . . . . . . . . . . . . . . . -57.3 -32.38 66.59 Favored 'General case' 0 CA--C 1.538 0.495 0 O-C-N 121.851 -0.531 . . . . 0.0 110.919 179.352 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 30.5 m -69.52 12.59 0.12 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.722 0 C-N-CA 127.061 2.144 . . . . 0.0 112.535 179.062 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 6' ' ' ARG . . . . . . . . . . . . . 20.0 ttp85 -67.27 2.39 1.66 Allowed 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 126.998 2.119 . . . . 0.0 112.315 178.951 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -142.35 165.23 27.98 Favored 'General case' 0 C--O 1.239 0.538 0 C-N-CA 128.833 2.853 . . . . 0.0 104.424 178.029 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 16.8 pttt -141.71 111.63 6.73 Favored 'General case' 0 CA--C 1.519 -0.238 0 N-CA-C 113.314 0.857 . . . . 0.0 113.314 -178.315 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 5.3 p -70.08 -8.53 50.21 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 125.151 1.38 . . . . 0.0 110.856 178.328 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 10' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -145.84 157.9 43.89 Favored 'General case' 0 N--CA 1.444 -0.74 0 C-N-CA 124.486 1.115 . . . . 0.0 111.839 -178.701 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 11' ' ' VAL . . . . . . . . . . . . . 28.7 m -142.99 146.07 22.13 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 N-CA-C 103.75 -2.685 . . . . 0.0 103.75 177.569 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 12' ' ' ARG . . . . . . . . . . . . . 65.6 mtp85 -133.76 169.27 17.29 Favored 'General case' 0 C--O 1.245 0.822 0 N-CA-C 107.919 -1.141 . . . . 0.0 107.919 -179.46 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 13' ' ' GLN . . . . . . . . . . . . . 55.6 mm-40 -84.96 60.14 6.05 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 122.033 0.92 . . . . 0.0 109.017 178.69 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 14' ' ' LYS . . . . . 0.491 ' HE3' ' HG3' ' A' ' 24' ' ' PRO . 22.1 ptmt -61.22 -23.29 65.51 Favored 'General case' 0 C--O 1.223 -0.305 0 C-N-CA 125.611 1.564 . . . . 0.0 110.733 178.526 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 5.4 t -82.34 -171.17 3.3 Favored 'General case' 0 N--CA 1.436 -1.126 0 C-N-CA 125.072 1.349 . . . . 0.0 109.73 179.802 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 23.2 t -122.85 143.82 34.45 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.615 0 N-CA-C 105.537 -2.023 . . . . 0.0 105.537 179.234 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 6.4 p -143.74 97.66 0.58 Allowed 'Isoleucine or valine' 0 N--CA 1.443 -0.784 0 CA-C-O 122.471 1.129 . . . . 0.0 109.564 178.761 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 1.2 ttt85 -144.18 155.05 43.74 Favored 'General case' 0 N--CA 1.45 -0.463 0 CA-C-N 114.617 -1.174 . . . . 0.0 108.372 179.292 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -90.87 134.76 34.21 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 104.096 -2.557 . . . . 0.0 104.096 177.559 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 20' ' ' LEU . . . . . 0.407 ' HA ' HD12 ' B' ' 20' ' ' LEU . 11.3 tp -116.04 154.92 29.04 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-N 118.883 0.765 . . . . 0.0 109.673 179.497 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 18.4 mmt180 -126.54 150.28 48.89 Favored 'General case' 0 C--O 1.232 0.17 0 C-N-CA 125.762 1.625 . . . . 0.0 110.203 -178.93 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 22' ' ' PHE . . . . . . . . . . . . . 91.9 m-85 -145.82 143.91 29.94 Favored 'General case' 0 C--O 1.232 0.165 0 C-N-CA 125.587 1.555 . . . . 0.0 107.366 178.578 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 23' ' ' SER . . . . . 0.402 ' HB3' ' HD2' ' B' ' 24' ' ' PRO . 2.4 m -68.99 170.84 7.57 Favored Pre-proline 0 CA--C 1.542 0.652 0 CA-C-N 119.258 0.935 . . . . 0.0 109.997 179.323 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 24' ' ' PRO . . . . . 0.402 ' HD2' ' HB3' ' B' ' 23' ' ' SER . 36.8 Cg_endo -65.75 -44.81 7.43 Favored 'Trans proline' 0 C--N 1.349 0.584 0 C-N-CA 121.452 1.435 . . . . 0.0 113.139 -178.277 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 25' ' ' VAL . . . . . . . . . . . . . 21.8 t -65.87 -38.99 83.43 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.52 0 C-N-CA 123.918 0.887 . . . . 0.0 109.387 179.788 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 98.6 mt-10 -66.5 -40.93 89.52 Favored 'General case' 0 C--O 1.226 -0.173 0 C-N-CA 123.879 0.872 . . . . 0.0 108.858 179.488 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 27' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -62.89 -50.26 71.6 Favored 'General case' 0 CA--C 1.514 -0.412 0 C-N-CA 123.903 0.881 . . . . 0.0 109.518 179.195 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 28' ' ' GLU . . . . . . . . . . . . . 91.4 mt-10 -57.02 -43.35 81.78 Favored 'General case' 0 C--N 1.332 -0.191 0 C-N-CA 124.245 1.018 . . . . 0.0 109.542 178.689 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 80.0 m -63.23 -59.92 4.09 Favored 'General case' 0 N--CA 1.451 -0.421 0 N-CA-C 109.599 -0.519 . . . . 0.0 109.599 179.52 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 98.0 mt -58.09 -39.07 71.03 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.449 0 C-N-CA 123.961 0.904 . . . . 0.0 111.891 -178.686 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 24.1 ttt-85 -67.08 -48.4 68.34 Favored 'General case' 0 N--CA 1.453 -0.277 0 O-C-N 121.399 -0.813 . . . . 0.0 108.977 -179.855 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 2.1 mptp? -60.94 -46.98 88.52 Favored 'General case' 0 CA--C 1.515 -0.386 0 N-CA-C 108.82 -0.807 . . . . 0.0 108.82 -179.89 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 58.7 mmtt -63.59 -43.91 95.56 Favored 'General case' 0 C--O 1.22 -0.448 0 CA-C-O 118.053 -0.975 . . . . 0.0 110.619 -179.498 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 34' ' ' ALA . . . . . . . . . . . . . . . -58.21 -50.94 71.79 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 119.6 1.091 . . . . 0.0 109.237 178.618 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 27.6 tt0 -60.06 -45.03 94.23 Favored 'General case' 0 N--CA 1.454 -0.255 0 C-N-CA 124.144 0.977 . . . . 0.0 111.779 -179.185 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 36' ' ' ASP . . . . . . . . . . . . . 25.3 t0 -68.73 -37.53 79.53 Favored 'General case' 0 C--N 1.331 -0.215 0 C-N-CA 125.332 1.453 . . . . 0.0 110.418 -179.362 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 37' ' ' SER . . . . . . . . . . . . . 32.8 t -73.0 -11.2 60.48 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 126.409 1.884 . . . . 0.0 110.04 178.723 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 68.33 26.89 74.02 Favored Glycine 0 CA--C 1.525 0.689 0 O-C-N 121.246 -0.909 . . . . 0.0 111.259 -179.447 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 39' ' ' LEU . . . . . . . . . . . . . 82.2 mt -121.17 142.29 50.03 Favored 'General case' 0 N--CA 1.445 -0.678 0 C-N-CA 125.2 1.4 . . . . 0.0 107.588 -179.717 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 40' ' ' THR . . . . . . . . . . . . . 2.0 t -64.61 146.31 54.86 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 105.367 -2.086 . . . . 0.0 105.367 177.036 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 41' ' ' VAL . . . . . . . . . . . . . 2.2 t -45.94 -51.27 3.65 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.469 0 C-N-CA 124.748 1.219 . . . . 0.0 111.538 179.303 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 42' ' ' SER . . . . . . . . . . . . . 1.5 p -58.09 -31.54 67.21 Favored 'General case' 0 CA--C 1.544 0.741 0 O-C-N 120.325 -1.485 . . . . 0.0 112.686 -179.199 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -78.46 -40.8 34.57 Favored 'General case' 0 C--O 1.224 -0.256 0 C-N-CA 124.694 1.198 . . . . 0.0 109.047 177.71 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 44' ' ' TYR . . . . . . . . . . . . . 24.6 t80 -57.37 -51.85 67.74 Favored 'General case' 0 N--CA 1.455 -0.224 0 N-CA-C 108.409 -0.959 . . . . 0.0 108.409 179.442 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 45' ' ' ILE . . . . . 0.461 HG23 HG23 ' A' ' 45' ' ' ILE . 28.0 mm -54.16 -60.67 1.27 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.309 0 C-N-CA 123.358 0.663 . . . . 0.0 111.676 179.499 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 46' ' ' ARG . . . . . . . . . . . . . 9.9 ptt180 -56.48 -43.19 79.39 Favored 'General case' 0 C--O 1.224 -0.264 0 CA-C-O 119.171 -0.442 . . . . 0.0 111.23 -178.519 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 47' ' ' ASN . . . . . . . . . . . . . 39.0 t30 -60.41 -55.93 27.63 Favored 'General case' 0 N--CA 1.446 -0.642 0 C-N-CA 123.885 0.874 . . . . 0.0 111.944 -179.198 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -60.2 -33.33 72.09 Favored 'General case' 0 CA--C 1.53 0.185 0 O-C-N 124.17 0.919 . . . . 0.0 112.564 -179.069 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 49' ' ' ALA . . . . . . . . . . . . . . . -74.0 -24.33 59.57 Favored 'General case' 0 C--N 1.333 -0.145 0 N-CA-C 113.986 1.106 . . . . 0.0 113.986 -178.929 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 24.0 mt -100.19 -43.13 6.41 Favored 'General case' 0 CA--C 1.514 -0.407 0 N-CA-C 113.423 0.897 . . . . 0.0 113.423 -178.672 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 51' ' ' ASN . . . . . . . . . . . . . 26.6 m-80 . . . . . 0 C--O 1.249 1.062 0 C-N-CA 125.179 1.392 . . . . 0.0 107.649 -177.514 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 30.3 t . . . . . 0 N--CA 1.466 0.359 0 N-CA-C 104.068 -2.567 . . . . 0.0 104.068 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 11.7 p-10 -59.44 -41.46 89.68 Favored 'General case' 0 C--N 1.328 -0.344 0 C-N-CA 129.158 2.983 . . . . 0.0 109.471 177.662 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 13.9 t -153.11 -177.58 6.4 Favored 'General case' 0 N--CA 1.444 -0.751 0 C-N-CA 125.174 1.389 . . . . 0.0 109.432 -179.324 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -163.7 93.58 0.74 Allowed 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 128.346 2.658 . . . . 0.0 107.51 179.448 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 13.5 p -67.05 -30.03 48.15 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.699 0 O-C-N 121.613 -0.679 . . . . 0.0 111.694 179.697 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 48.7 ttt85 -67.54 149.36 50.25 Favored 'General case' 0 C--N 1.341 0.23 0 N-CA-C 108.174 -1.047 . . . . 0.0 108.174 179.497 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 1.7 pttm -137.01 173.74 11.37 Favored 'General case' 0 C--O 1.237 0.437 0 C-N-CA 123.855 0.862 . . . . 0.0 111.36 -178.223 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 53.6 mtmt -122.05 28.88 7.31 Favored 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 126.3 1.84 . . . . 0.0 111.413 -178.979 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 1.6 p -73.16 -16.17 61.44 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 124.617 1.167 . . . . 0.0 112.033 179.427 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 7.6 mt-10 -73.6 94.81 2.21 Favored 'General case' 0 C--N 1.34 0.176 0 C-N-CA 124.048 0.939 . . . . 0.0 109.023 -179.996 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.415 HG22 ' H ' ' A' ' 11' ' ' VAL . 6.1 m -67.85 -15.81 20.19 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 C-N-CA 126.238 1.815 . . . . 0.0 114.367 -179.882 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 4.9 tmm_? -61.49 130.89 48.21 Favored 'General case' 0 C--O 1.237 0.407 0 CA-C-N 119.974 1.261 . . . . 0.0 108.72 -179.637 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 23.5 mm100 -52.87 99.49 0.02 OUTLIER 'General case' 0 C--O 1.233 0.221 0 C-N-CA 125.757 1.623 . . . . 0.0 109.524 179.749 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 33.7 pttt -73.18 -24.55 60.56 Favored 'General case' 0 N--CA 1.463 0.193 0 C-N-CA 125.126 1.37 . . . . 0.0 111.847 -179.25 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 4.7 t -72.15 -174.89 1.36 Allowed 'General case' 0 N--CA 1.446 -0.635 0 N-CA-C 107.266 -1.383 . . . . 0.0 107.266 177.835 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 13.5 t -131.32 157.98 43.26 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 N-CA-C 106.01 -1.848 . . . . 0.0 106.01 -179.673 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 13.6 p -149.16 116.98 0.9 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.444 0 N-CA-C 106.881 -1.525 . . . . 0.0 106.881 178.898 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 25.1 ttt180 -153.26 161.22 42.63 Favored 'General case' 0 N--CA 1.466 0.339 0 O-C-N 121.691 -0.631 . . . . 0.0 110.153 -179.847 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -106.32 127.79 53.51 Favored 'General case' 0 C--O 1.24 0.58 0 N-CA-C 105.052 -2.203 . . . . 0.0 105.052 179.102 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -128.24 120.31 26.92 Favored 'General case' 0 CA--C 1.529 0.162 0 C-N-CA 124.284 1.034 . . . . 0.0 109.602 -178.448 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 15.6 mmt85 -83.84 156.97 22.2 Favored 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 124.811 1.244 . . . . 0.0 110.665 -179.768 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 70.6 m-85 -144.61 155.31 43.56 Favored 'General case' 0 N--CA 1.463 0.224 0 C-N-CA 125.355 1.462 . . . . 0.0 108.315 178.55 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . 0.457 ' HB3' ' HD2' ' A' ' 24' ' ' PRO . 39.1 m -79.9 171.08 13.34 Favored Pre-proline 0 CA--C 1.545 0.783 0 C-N-CA 123.976 0.91 . . . . 0.0 108.904 179.095 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . 0.457 ' HD2' ' HB3' ' A' ' 23' ' ' SER . 35.0 Cg_endo -64.75 -54.61 0.68 Allowed 'Trans proline' 0 C--N 1.351 0.674 0 C-N-CA 121.961 1.774 . . . . 0.0 112.027 -178.012 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 33.7 t -58.91 -42.02 84.68 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.337 0 C-N-CA 123.359 0.664 . . . . 0.0 110.013 -179.716 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -63.55 -50.24 70.29 Favored 'General case' 0 C--O 1.227 -0.092 0 C-N-CA 123.289 0.635 . . . . 0.0 110.856 -179.576 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 7.1 t70 -59.65 -47.04 87.18 Favored 'General case' 0 C--O 1.221 -0.398 0 C-N-CA 123.859 0.864 . . . . 0.0 110.224 179.218 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 44.8 tt0 -58.18 -44.71 88.15 Favored 'General case' 0 N--CA 1.449 -0.523 0 C-N-CA 124.628 1.171 . . . . 0.0 109.217 179.945 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 68.7 m -60.42 -52.18 66.32 Favored 'General case' 0 CA--C 1.538 0.51 0 N-CA-C 108.793 -0.818 . . . . 0.0 108.793 178.886 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 72.3 mt -59.26 -45.99 92.63 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.211 0 C-N-CA 123.379 0.672 . . . . 0.0 109.752 -179.684 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 62.8 ttt180 -61.06 -40.98 95.7 Favored 'General case' 0 C--O 1.234 0.255 0 C-N-CA 124.237 1.015 . . . . 0.0 110.308 -179.525 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -68.34 -52.65 31.0 Favored 'General case' 0 CA--C 1.52 -0.201 0 CA-C-N 118.644 0.656 . . . . 0.0 110.33 179.461 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 75.9 mttt -60.99 -43.44 98.85 Favored 'General case' 0 CA--C 1.518 -0.262 0 CA-C-N 119.021 0.828 . . . . 0.0 111.122 -178.584 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -56.82 -54.16 49.64 Favored 'General case' 0 N--CA 1.452 -0.337 0 C-N-CA 123.936 0.894 . . . . 0.0 109.477 179.235 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 31.3 tt0 -62.82 -41.46 99.33 Favored 'General case' 0 N--CA 1.455 -0.185 0 N-CA-C 112.908 0.707 . . . . 0.0 112.908 -178.516 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -62.95 -39.3 94.22 Favored 'General case' 0 N--CA 1.453 -0.309 0 C-N-CA 125.451 1.501 . . . . 0.0 108.574 179.449 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 8.7 t -78.89 -9.76 59.59 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 123.815 0.846 . . . . 0.0 109.967 177.776 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 64.71 27.08 71.51 Favored Glycine 0 N--CA 1.442 -0.928 0 C-N-CA 125.955 1.74 . . . . 0.0 112.078 -179.458 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 13.3 mt -118.3 138.1 52.61 Favored 'General case' 0 CA--C 1.518 -0.287 0 N-CA-C 103.851 -2.648 . . . . 0.0 103.851 179.292 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . 0.453 HG23 ' H ' ' A' ' 43' ' ' ALA . 5.5 t -56.4 151.85 12.4 Favored 'General case' 0 CA--C 1.534 0.333 0 N-CA-C 108.968 -0.753 . . . . 0.0 108.968 178.942 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 24.4 t -52.14 -37.1 21.57 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.363 0 N-CA-C 109.106 -0.702 . . . . 0.0 109.106 177.865 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 12.2 m -62.09 -30.46 71.02 Favored 'General case' 0 CA--C 1.541 0.605 0 O-C-N 121.138 -0.976 . . . . 0.0 112.646 179.893 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.453 ' H ' HG23 ' A' ' 40' ' ' THR . . . -81.82 -46.51 14.07 Favored 'General case' 0 CA--C 1.516 -0.356 0 N-CA-C 106.535 -1.654 . . . . 0.0 106.535 177.852 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 82.0 t80 -51.39 -52.68 43.71 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 124.091 0.956 . . . . 0.0 109.327 -179.684 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 13.1 mm -53.0 -64.01 0.43 Allowed 'Isoleucine or valine' 0 C--N 1.34 0.173 0 C-N-CA 126.079 1.752 . . . . 0.0 110.801 179.479 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -54.61 -47.95 72.78 Favored 'General case' 0 C--O 1.22 -0.487 0 CA-C-O 119.133 -0.461 . . . . 0.0 111.305 -178.2 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 11.3 t30 -58.76 -49.79 76.35 Favored 'General case' 0 N--CA 1.445 -0.713 0 C-N-CA 123.455 0.702 . . . . 0.0 112.427 -178.877 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -64.98 -31.97 73.46 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 123.388 0.675 . . . . 0.0 111.146 179.337 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -75.86 -35.65 59.85 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 124.156 0.982 . . . . 0.0 113.05 -179.742 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.454 HD21 ' HA ' ' B' ' 26' ' ' GLU . 22.5 mt -77.54 -44.56 28.18 Favored 'General case' 0 CA--C 1.515 -0.398 0 N-CA-C 113.817 1.043 . . . . 0.0 113.817 -177.81 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 57.9 m-80 . . . . . 0 C--O 1.249 1.047 0 CA-C-O 117.774 -1.108 . . . . 0.0 111.233 179.632 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 1' ' ' SER . . . . . . . . . . . . . 12.8 t . . . . . 0 N--CA 1.466 0.356 0 N-CA-C 104.426 -2.435 . . . . 0.0 104.426 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 2' ' ' ASP . . . . . . . . . . . . . 7.7 p-10 -54.34 -37.77 65.27 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 128.581 2.753 . . . . 0.0 107.76 176.732 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 3' ' ' SER . . . . . . . . . . . . . 22.7 t -145.51 177.36 8.92 Favored 'General case' 0 N--CA 1.435 -1.182 0 C-N-CA 128.745 2.818 . . . . 0.0 105.925 178.874 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 4' ' ' ALA . . . . . . . . . . . . . . . -175.81 88.98 0.04 OUTLIER 'General case' 0 N--CA 1.452 -0.354 0 C-N-CA 126.49 1.916 . . . . 0.0 107.387 179.456 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 12.9 p -57.88 -22.04 17.91 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.66 0 C-N-CA 124.48 1.112 . . . . 0.0 113.388 -179.74 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 6' ' ' ARG . . . . . . . . . . . . . 30.0 ttt180 -63.0 149.31 45.26 Favored 'General case' 0 CA--C 1.536 0.414 0 O-C-N 121.245 -0.909 . . . . 0.0 109.778 179.786 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -139.26 -173.36 3.57 Favored 'General case' 0 C--O 1.237 0.407 0 C-N-CA 124.591 1.156 . . . . 0.0 108.988 179.347 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 46.0 mtmt -133.93 40.74 3.06 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 124.167 0.987 . . . . 0.0 111.39 -178.309 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 1.7 p -68.42 -8.9 44.71 Favored 'General case' 0 CA--C 1.538 0.517 0 N-CA-C 114.302 1.223 . . . . 0.0 114.302 -179.736 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 10' ' ' GLU . . . . . . . . . . . . . 19.1 mp0 -83.8 78.57 9.69 Favored 'General case' 0 N--CA 1.45 -0.445 0 C-N-CA 125.118 1.367 . . . . 0.0 110.231 -177.936 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 11' ' ' VAL . . . . . . . . . . . . . 27.0 m -66.54 -8.16 6.84 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.565 0 C-N-CA 125.111 1.364 . . . . 0.0 113.405 179.869 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 12' ' ' ARG . . . . . . . . . . . . . 4.4 tmm_? -64.47 153.36 39.11 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-N 119.578 1.081 . . . . 0.0 108.462 179.452 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 13' ' ' GLN . . . . . . . . . . . . . 28.4 mm100 -60.05 110.35 1.18 Allowed 'General case' 0 C--O 1.231 0.114 0 N-CA-C 109.532 -0.544 . . . . 0.0 109.532 179.326 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 33.8 pttt -85.61 -27.16 25.64 Favored 'General case' 0 C--N 1.331 -0.209 0 C-N-CA 123.197 0.599 . . . . 0.0 110.033 179.128 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 2.9 t -74.54 -168.96 0.76 Allowed 'General case' 0 N--CA 1.445 -0.713 0 N-CA-C 107.391 -1.337 . . . . 0.0 107.391 178.088 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 2.9 t -141.02 154.54 21.1 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.719 0 N-CA-C 106.432 -1.692 . . . . 0.0 106.432 179.24 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 14.0 p -141.53 114.51 4.37 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.646 0 N-CA-C 106.725 -1.583 . . . . 0.0 106.725 178.579 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 7.9 ttt180 -149.26 148.56 29.71 Favored 'General case' 0 N--CA 1.47 0.553 0 N-CA-C 108.166 -1.05 . . . . 0.0 108.166 178.691 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 2.6 m -101.2 116.66 33.33 Favored 'General case' 0 C--O 1.236 0.376 0 N-CA-C 107.982 -1.118 . . . . 0.0 107.982 -179.614 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -115.28 159.96 20.36 Favored 'General case' 0 C--O 1.235 0.296 0 C-N-CA 124.412 1.085 . . . . 0.0 109.97 -179.508 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 1.5 mtt85 -125.99 162.9 24.19 Favored 'General case' 0 N--CA 1.443 -0.787 0 C-N-CA 124.711 1.204 . . . . 0.0 110.721 178.439 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 22' ' ' PHE . . . . . . . . . . . . . 92.9 m-85 -140.65 146.66 38.18 Favored 'General case' 0 N--CA 1.454 -0.27 0 C-N-CA 124.985 1.314 . . . . 0.0 107.996 179.749 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 14.8 m -73.91 168.75 23.06 Favored Pre-proline 0 CA--C 1.548 0.887 0 N-CA-C 106.714 -1.587 . . . . 0.0 106.714 178.276 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 24' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_endo -63.0 -44.27 16.41 Favored 'Trans proline' 0 N--CA 1.459 -0.523 0 C-N-CA 121.456 1.437 . . . . 0.0 112.825 -178.112 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 25' ' ' VAL . . . . . . . . . . . . . 75.1 t -64.87 -40.22 88.33 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.276 0 C-N-CA 123.894 0.878 . . . . 0.0 110.168 179.609 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 26' ' ' GLU . . . . . 0.454 ' HA ' HD21 ' A' ' 50' ' ' LEU . 81.9 mt-10 -62.76 -51.05 68.66 Favored 'General case' 0 N--CA 1.453 -0.316 0 N-CA-C 109.494 -0.558 . . . . 0.0 109.494 -179.343 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 27' ' ' ASP . . . . . . . . . . . . . 17.7 t70 -59.28 -47.48 85.2 Favored 'General case' 0 CA--C 1.511 -0.543 0 C-N-CA 125.165 1.386 . . . . 0.0 111.428 179.875 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 28' ' ' GLU . . . . . . . . . . . . . 73.2 tt0 -57.6 -46.91 83.46 Favored 'General case' 0 N--CA 1.447 -0.594 0 C-N-CA 124.589 1.156 . . . . 0.0 109.108 179.421 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 55.9 m -61.82 -57.86 10.22 Favored 'General case' 0 CA--C 1.533 0.323 0 N-CA-C 109.618 -0.512 . . . . 0.0 109.618 179.067 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 90.2 mt -53.92 -46.13 64.19 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.1 0 C-N-CA 123.539 0.736 . . . . 0.0 110.671 -178.066 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 63.0 ttt180 -61.14 -47.92 83.98 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-O 118.688 -0.672 . . . . 0.0 110.72 -179.665 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -65.24 -46.32 81.04 Favored 'General case' 0 CA--C 1.517 -0.302 0 CA-C-O 118.617 -0.706 . . . . 0.0 110.214 -179.073 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 65.1 mttt -59.22 -47.82 83.93 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-N 118.935 0.789 . . . . 0.0 110.276 -179.497 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 34' ' ' ALA . . . . . . . . . . . . . . . -57.86 -56.45 21.82 Favored 'General case' 0 N--CA 1.45 -0.457 0 C-N-CA 124.229 1.011 . . . . 0.0 110.248 179.802 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 17.4 tt0 -62.94 -34.6 77.82 Favored 'General case' 0 C--N 1.33 -0.253 0 C-N-CA 123.796 0.839 . . . . 0.0 112.783 -177.681 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 36' ' ' ASP . . . . . . . . . . . . . 5.3 t70 -67.94 -42.36 81.12 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 108.263 -1.014 . . . . 0.0 108.263 178.715 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 37' ' ' SER . . . . . . . . . . . . . 31.8 t -71.98 -27.0 62.47 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-O 121.244 0.545 . . . . 0.0 109.861 179.412 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 97.72 -4.05 61.26 Favored Glycine 0 CA--C 1.523 0.541 0 C-N-CA 125.203 1.382 . . . . 0.0 111.877 -179.712 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 39' ' ' LEU . . . . . . . . . . . . . 31.8 mt -87.85 144.29 26.67 Favored 'General case' 0 N--CA 1.438 -1.038 0 C-N-CA 125.255 1.422 . . . . 0.0 107.168 -179.959 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 40' ' ' THR . . . . . . . . . . . . . 1.8 t -68.39 147.25 52.35 Favored 'General case' 0 C--N 1.313 -0.988 0 N-CA-C 106.039 -1.837 . . . . 0.0 106.039 177.56 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 41' ' ' VAL . . . . . . . . . . . . . 53.7 t -49.88 -38.26 13.77 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.446 0 O-C-N 121.524 -0.735 . . . . 0.0 110.926 179.144 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 42' ' ' SER . . . . . . . . . . . . . 14.1 p -61.67 -37.78 85.33 Favored 'General case' 0 CA--C 1.533 0.327 0 O-C-N 121.071 -1.018 . . . . 0.0 111.836 179.651 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -73.73 -43.3 59.54 Favored 'General case' 0 C--N 1.341 0.211 0 C-N-CA 125.802 1.641 . . . . 0.0 108.3 178.492 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 44' ' ' TYR . . . . . . . . . . . . . 47.2 t80 -56.08 -50.01 72.2 Favored 'General case' 0 N--CA 1.451 -0.378 0 C-N-CA 123.721 0.809 . . . . 0.0 109.323 179.489 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 45' ' ' ILE . . . . . . . . . . . . . 12.8 mm -52.56 -63.93 0.43 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.291 0 C-N-CA 124.786 1.235 . . . . 0.0 110.727 179.765 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 46' ' ' ARG . . . . . . . . . . . . . 15.2 ptp180 -55.36 -48.06 74.83 Favored 'General case' 0 C--O 1.226 -0.161 0 C-N-CA 123.602 0.761 . . . . 0.0 112.081 -179.5 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 47' ' ' ASN . . . . . . . . . . . . . 29.9 t30 -59.42 -53.17 61.19 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-O 118.717 -0.659 . . . . 0.0 111.141 -179.347 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -63.28 -32.76 74.26 Favored 'General case' 0 C--O 1.224 -0.24 0 C-N-CA 123.753 0.821 . . . . 0.0 112.283 -179.574 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 49' ' ' ALA . . . . . . . . . . . . . . . -68.62 -37.03 79.42 Favored 'General case' 0 C--O 1.232 0.167 0 O-C-N 121.758 -0.589 . . . . 0.0 111.145 179.931 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 21.4 mt -79.8 -41.36 26.62 Favored 'General case' 0 CA--C 1.521 -0.147 0 CA-C-O 119.1 -0.476 . . . . 0.0 110.439 -179.687 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 51' ' ' ASN . . . . . . . . . . . . . 57.5 m-80 . . . . . 0 C--O 1.253 1.286 0 C-N-CA 124.335 1.054 . . . . 0.0 111.295 -178.492 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 32.6 m . . . . . 0 N--CA 1.482 1.163 0 N-CA-C 104.464 -2.421 . . . . 0.0 104.464 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -124.86 -13.65 6.86 Favored 'General case' 0 C--N 1.321 -0.644 0 C-N-CA 127.865 2.466 . . . . 0.0 113.045 -172.701 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 26.5 t -73.19 117.81 15.38 Favored 'General case' 0 CA--C 1.532 0.251 0 N-CA-C 108.509 -0.923 . . . . 0.0 108.509 179.157 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -97.87 -13.1 21.44 Favored 'General case' 0 CA--C 1.536 0.441 0 N-CA-C 113.33 0.863 . . . . 0.0 113.33 -179.926 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 2.6 t 37.38 44.53 0.25 Allowed 'Isoleucine or valine' 0 CA--C 1.547 0.861 0 C-N-CA 128.138 2.575 . . . . 0.0 112.9 -179.733 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 9.6 mmp_? -68.54 132.49 47.04 Favored 'General case' 0 C--O 1.234 0.26 0 N-CA-C 107.206 -1.405 . . . . 0.0 107.206 179.889 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 38.4 tttm -141.51 -18.94 0.77 Allowed 'General case' 0 N--CA 1.465 0.318 0 C-N-CA 123.611 0.765 . . . . 0.0 112.455 179.936 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 35.7 pttt -157.83 86.14 0.91 Allowed 'General case' 0 C--N 1.332 -0.187 0 N-CA-C 106.296 -1.742 . . . . 0.0 106.296 179.296 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 18.5 m -53.57 -45.27 69.88 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 123.479 0.712 . . . . 0.0 109.484 -179.765 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 37.6 mt-10 -153.87 160.17 42.06 Favored 'General case' 0 N--CA 1.452 -0.351 0 C-N-CA 126.115 1.766 . . . . 0.0 107.189 178.782 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 2.7 t -144.98 103.82 0.69 Allowed 'Isoleucine or valine' 0 N--CA 1.457 -0.089 0 N-CA-C 105.714 -1.958 . . . . 0.0 105.714 178.635 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 47.4 mtp180 -52.26 -52.62 51.56 Favored 'General case' 0 N--CA 1.467 0.395 0 C-N-CA 124.113 0.965 . . . . 0.0 109.085 -179.578 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 14.4 pt20 -120.28 85.24 2.35 Favored 'General case' 0 N--CA 1.447 -0.594 0 C-N-CA 126.215 1.806 . . . . 0.0 108.003 179.74 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 21.5 ptmt -65.48 -35.79 81.94 Favored 'General case' 0 C--O 1.222 -0.372 0 CA-C-N 115.588 -0.733 . . . . 0.0 111.382 179.457 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 4.0 t -81.59 167.29 19.41 Favored 'General case' 0 N--CA 1.446 -0.637 0 C-N-CA 123.97 0.908 . . . . 0.0 108.883 178.778 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 2.4 t -119.05 156.48 21.12 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 C-N-CA 125.954 1.701 . . . . 0.0 106.623 178.485 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 14.8 p -144.47 123.47 6.72 Favored 'Isoleucine or valine' 0 C--O 1.238 0.499 0 N-CA-C 106.73 -1.582 . . . . 0.0 106.73 178.928 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 13.7 ttm180 -154.51 164.92 37.95 Favored 'General case' 0 C--O 1.234 0.266 0 O-C-N 121.674 -0.641 . . . . 0.0 109.516 179.416 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 3.8 m -107.84 135.32 49.44 Favored 'General case' 0 N--CA 1.448 -0.542 0 N-CA-C 105.327 -2.101 . . . . 0.0 105.327 178.721 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 43.9 mt -129.91 108.76 10.37 Favored 'General case' 0 CA--C 1.512 -0.513 0 N-CA-C 108.584 -0.895 . . . . 0.0 108.584 179.293 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -77.86 150.32 34.19 Favored 'General case' 0 N--CA 1.45 -0.462 0 N-CA-C 107.213 -1.403 . . . . 0.0 107.213 177.555 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 66.6 m-85 -144.02 161.74 38.0 Favored 'General case' 0 C--O 1.237 0.433 0 N-CA-C 106.508 -1.664 . . . . 0.0 106.508 178.185 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . 0.413 ' HB3' ' HD2' ' A' ' 24' ' ' PRO . 36.7 m -92.71 167.6 14.21 Favored Pre-proline 0 CA--C 1.538 0.483 0 C-N-CA 124.58 1.152 . . . . 0.0 109.407 179.453 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . 0.413 ' HD2' ' HB3' ' A' ' 23' ' ' SER . 55.4 Cg_endo -63.01 -29.81 75.82 Favored 'Trans proline' 0 C--N 1.347 0.45 0 C-N-CA 122.861 2.374 . . . . 0.0 113.306 -178.808 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 71.6 t -68.63 -54.61 19.99 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.455 0 N-CA-C 107.381 -1.34 . . . . 0.0 107.381 179.134 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 28.0 mt-10 -59.45 -44.08 93.04 Favored 'General case' 0 C--O 1.223 -0.302 0 C-N-CA 125.231 1.412 . . . . 0.0 110.58 179.964 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -62.13 -48.54 79.69 Favored 'General case' 0 CA--C 1.512 -0.489 0 C-N-CA 125.667 1.587 . . . . 0.0 110.919 179.984 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 76.7 tt0 -59.69 -42.4 92.89 Favored 'General case' 0 N--CA 1.453 -0.284 0 N-CA-C 108.509 -0.923 . . . . 0.0 108.509 178.486 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 18.8 m -62.26 -60.31 3.77 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 123.461 0.704 . . . . 0.0 109.559 -179.932 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 96.5 mt -57.87 -39.54 71.83 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.163 0 C-N-CA 124.195 0.998 . . . . 0.0 111.064 -178.965 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 19.8 ttt180 -69.36 -37.11 77.46 Favored 'General case' 0 C--N 1.332 -0.186 0 O-C-N 120.907 -1.12 . . . . 0.0 110.675 -179.81 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 2.2 mptp? -70.15 -49.24 52.55 Favored 'General case' 0 CA--C 1.517 -0.29 0 N-CA-C 109.385 -0.598 . . . . 0.0 109.385 178.973 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 3.2 mptp? -63.81 -46.48 84.97 Favored 'General case' 0 CA--C 1.511 -0.521 0 C-N-CA 124.478 1.111 . . . . 0.0 110.682 -178.462 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -59.27 -53.96 52.3 Favored 'General case' 0 N--CA 1.452 -0.368 0 CA-C-N 119.137 0.881 . . . . 0.0 109.794 179.611 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 41.9 tt0 -62.45 -38.06 88.3 Favored 'General case' 0 CA--C 1.532 0.282 0 N-CA-C 112.011 0.374 . . . . 0.0 112.011 -178.099 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 31.6 t70 -69.64 -37.95 76.97 Favored 'General case' 0 C--O 1.233 0.228 0 C-N-CA 123.535 0.734 . . . . 0.0 109.878 179.194 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 10.4 t -72.37 -8.04 52.84 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 124.224 1.01 . . . . 0.0 108.639 177.802 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 71.03 6.72 60.99 Favored Glycine 0 C--N 1.341 0.86 0 C-N-CA 126.098 1.808 . . . . 0.0 113.108 -179.488 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 15.3 mt -101.66 161.05 13.93 Favored 'General case' 0 N--CA 1.441 -0.888 0 C-N-CA 126.161 1.784 . . . . 0.0 107.127 -179.491 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . 0.496 HG23 ' H ' ' A' ' 43' ' ' ALA . 5.1 t -81.04 155.16 26.48 Favored 'General case' 0 C--N 1.313 -1.012 0 O-C-N 120.42 -1.425 . . . . 0.0 107.641 178.781 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 20.8 t -51.65 -39.75 24.41 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.407 0 C-N-CA 124.87 1.268 . . . . 0.0 110.099 178.659 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 15.2 p -61.44 -50.46 72.7 Favored 'General case' 0 CA--C 1.534 0.35 0 O-C-N 121.907 -0.496 . . . . 0.0 109.987 179.303 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.496 ' H ' HG23 ' A' ' 40' ' ' THR . . . -59.86 -48.84 80.05 Favored 'General case' 0 CA--C 1.519 -0.217 0 C-N-CA 125.737 1.615 . . . . 0.0 109.959 178.997 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 81.9 t80 -51.14 -49.56 60.61 Favored 'General case' 0 N--CA 1.45 -0.47 0 C-N-CA 124.814 1.246 . . . . 0.0 109.803 -179.873 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 13.9 mm -57.67 -65.01 0.46 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.394 0 C-N-CA 124.067 0.947 . . . . 0.0 110.62 179.373 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 7.2 ptp180 -53.81 -41.65 67.54 Favored 'General case' 0 C--N 1.341 0.198 0 CA-C-O 117.886 -1.054 . . . . 0.0 111.906 -178.424 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 28.9 t30 -61.88 -55.89 25.02 Favored 'General case' 0 N--CA 1.453 -0.312 0 C-N-CA 124.014 0.926 . . . . 0.0 110.127 179.68 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -61.5 -29.55 70.05 Favored 'General case' 0 C--O 1.224 -0.248 0 C-N-CA 123.176 0.59 . . . . 0.0 112.288 -179.133 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -77.6 -26.38 50.62 Favored 'General case' 0 N--CA 1.451 -0.412 0 N-CA-C 113.148 0.796 . . . . 0.0 113.148 179.885 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 18.5 mt -88.92 -42.69 11.67 Favored 'General case' 0 CA--C 1.514 -0.413 0 O-C-N 121.031 -1.043 . . . . 0.0 109.346 -179.679 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 5.5 m-80 . . . . . 0 C--O 1.242 0.683 0 O-C-N 124.628 1.205 . . . . 0.0 107.883 179.461 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 1' ' ' SER . . . . . . . . . . . . . 30.2 m . . . . . 0 N--CA 1.482 1.132 0 N-CA-C 103.708 -2.701 . . . . 0.0 103.708 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 2' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -127.16 -11.96 5.8 Favored 'General case' 0 N--CA 1.447 -0.596 0 CA-C-N 112.915 -1.948 . . . . 0.0 114.144 -172.08 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 3' ' ' SER . . . . . . . . . . . . . 19.0 t -71.41 118.35 14.11 Favored 'General case' 0 N--CA 1.453 -0.296 0 N-CA-C 106.712 -1.588 . . . . 0.0 106.712 178.903 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 4' ' ' ALA . . . . . . . . . . . . . . . -71.44 -15.39 62.34 Favored 'General case' 0 CA--C 1.537 0.479 0 N-CA-C 113.327 0.862 . . . . 0.0 113.327 -179.778 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 3.5 t 43.25 48.35 0.37 Allowed 'Isoleucine or valine' 0 CA--C 1.546 0.824 0 C-N-CA 126.994 2.118 . . . . 0.0 112.319 -179.326 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 6' ' ' ARG . . . . . . . . . . . . . 15.6 mmp_? -98.92 148.85 23.54 Favored 'General case' 0 N--CA 1.464 0.229 0 O-C-N 120.351 -1.468 . . . . 0.0 107.319 178.613 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 36.5 tttm -154.12 -34.32 0.1 Allowed 'General case' 0 N--CA 1.465 0.32 0 C-N-CA 123.957 0.903 . . . . 0.0 111.868 -179.63 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 95.6 mttt -141.5 94.2 2.66 Favored 'General case' 0 N--CA 1.457 -0.093 0 N-CA-C 103.237 -2.875 . . . . 0.0 103.237 179.102 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 6.4 m -57.85 -58.74 7.04 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 119.34 0.973 . . . . 0.0 108.4 -179.439 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 10' ' ' GLU . . . . . . . . . . . . . 5.1 pm0 -137.54 162.25 34.24 Favored 'General case' 0 N--CA 1.452 -0.35 0 C-N-CA 125.301 1.44 . . . . 0.0 107.937 179.084 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 11' ' ' VAL . . . . . . . . . . . . . 68.6 t -146.11 123.57 4.15 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.337 0 N-CA-C 108.093 -1.077 . . . . 0.0 108.093 -179.948 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 12' ' ' ARG . . . . . . . . . . . . . 17.5 mtp180 -67.92 -57.69 5.79 Favored 'General case' 0 N--CA 1.468 0.43 0 C-N-CA 123.804 0.842 . . . . 0.0 110.234 -179.741 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 13' ' ' GLN . . . . . . . . . . . . . 72.4 mt-30 -120.3 90.44 3.33 Favored 'General case' 0 C--O 1.235 0.319 0 C-N-CA 125.453 1.501 . . . . 0.0 107.179 -179.528 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 17.5 ptmt -66.54 -33.29 75.36 Favored 'General case' 0 C--N 1.333 -0.138 0 C-N-CA 123.567 0.747 . . . . 0.0 111.159 179.683 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 1.3 t -74.48 176.08 7.16 Favored 'General case' 0 N--CA 1.443 -0.784 0 CA-C-O 122.152 0.977 . . . . 0.0 110.923 -179.768 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 41.0 t -117.76 146.66 21.94 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 C-N-CA 126.813 2.045 . . . . 0.0 105.902 179.02 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 7.2 p -146.07 107.76 0.77 Allowed 'Isoleucine or valine' 0 N--CA 1.451 -0.418 0 N-CA-C 105.343 -2.095 . . . . 0.0 105.343 178.326 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 9.8 ttt180 -149.52 166.43 29.21 Favored 'General case' 0 CA--C 1.509 -0.633 0 N-CA-C 109.978 -0.378 . . . . 0.0 109.978 -179.739 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 19.2 m -105.49 145.7 30.54 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 108.282 -1.007 . . . . 0.0 108.282 179.699 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 26.7 mt -135.5 143.5 45.84 Favored 'General case' 0 N--CA 1.443 -0.816 0 N-CA-C 106.481 -1.674 . . . . 0.0 106.481 177.405 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -114.91 143.2 45.52 Favored 'General case' 0 N--CA 1.448 -0.526 0 N-CA-C 105.434 -2.061 . . . . 0.0 105.434 178.976 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 22' ' ' PHE . . . . . . . . . . . . . 95.8 m-85 -136.46 140.98 43.5 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 106.145 -1.798 . . . . 0.0 106.145 179.632 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 4.6 m -74.87 169.08 21.76 Favored Pre-proline 0 CA--C 1.543 0.699 0 C-N-CA 123.33 0.652 . . . . 0.0 109.272 179.802 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 24' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo -67.06 -28.92 40.85 Favored 'Trans proline' 0 C--N 1.348 0.525 0 C-N-CA 122.025 1.817 . . . . 0.0 113.573 -178.294 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 25' ' ' VAL . . . . . . . . . . . . . 46.8 t -74.51 -48.34 35.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 N-CA-C 107.38 -1.341 . . . . 0.0 107.38 -179.666 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 26.8 mp0 -59.51 -43.28 93.42 Favored 'General case' 0 N--CA 1.448 -0.566 0 C-N-CA 125.071 1.348 . . . . 0.0 109.206 179.181 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 27' ' ' ASP . . . . . . . . . . . . . 19.3 t70 -63.65 -50.27 69.96 Favored 'General case' 0 C--O 1.224 -0.246 0 C-N-CA 124.252 1.021 . . . . 0.0 109.84 179.136 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 28' ' ' GLU . . . . . . . . . . . . . 64.1 tt0 -60.89 -17.21 49.33 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 125.138 1.375 . . . . 0.0 110.915 179.254 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 27.2 m -91.92 -61.44 1.63 Allowed 'General case' 0 N--CA 1.453 -0.317 0 N-CA-C 107.671 -1.233 . . . . 0.0 107.671 178.427 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 96.4 mt -58.17 -29.34 36.86 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.484 0 C-N-CA 124.109 0.964 . . . . 0.0 112.462 -178.388 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 61.8 ttt180 -73.58 -32.19 64.0 Favored 'General case' 0 C--N 1.328 -0.355 0 O-C-N 120.358 -1.464 . . . . 0.0 110.185 -179.959 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 3.7 mptp? -81.03 -50.51 9.58 Favored 'General case' 0 N--CA 1.456 -0.135 0 C-N-CA 123.584 0.754 . . . . 0.0 112.274 -179.475 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 4.6 mptp? -61.15 -42.06 97.88 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-O 118.95 -0.547 . . . . 0.0 110.785 -177.847 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 34' ' ' ALA . . . . . . . . . . . . . . . -60.1 -54.55 44.56 Favored 'General case' 0 N--CA 1.455 -0.213 0 C-N-CA 124.155 0.982 . . . . 0.0 108.794 179.614 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 16.4 tt0 -61.14 -36.38 79.63 Favored 'General case' 0 CA--C 1.532 0.273 0 N-CA-C 112.435 0.532 . . . . 0.0 112.435 -178.522 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 36' ' ' ASP . . . . . . . . . . . . . 5.8 t70 -70.85 -34.16 71.37 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 124.095 0.958 . . . . 0.0 110.279 178.88 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 37' ' ' SER . . . . . . . . . . . . . 9.6 t -79.69 -6.0 56.32 Favored 'General case' 0 N--CA 1.453 -0.309 0 C-N-CA 124.207 1.003 . . . . 0.0 111.906 179.388 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 68.03 20.55 72.9 Favored Glycine 0 CA--C 1.534 1.237 0 N-CA-C 110.642 -0.983 . . . . 0.0 110.642 -178.299 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 39' ' ' LEU . . . . . . . . . . . . . 55.4 mt -115.61 128.84 56.23 Favored 'General case' 0 CA--C 1.514 -0.413 0 N-CA-C 104.994 -2.224 . . . . 0.0 104.994 179.943 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 40' ' ' THR . . . . . . . . . . . . . 1.2 t -63.38 152.9 36.81 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 107.659 -1.237 . . . . 0.0 107.659 178.987 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 41' ' ' VAL . . . . . . . . . . . . . 40.2 t -47.64 -40.8 7.73 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.638 0 C-N-CA 124.454 1.102 . . . . 0.0 110.455 178.366 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 42' ' ' SER . . . . . . . . . . . . . 9.8 m -63.35 -36.62 84.3 Favored 'General case' 0 CA--C 1.546 0.791 0 O-C-N 119.827 -1.795 . . . . 0.0 111.667 179.809 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -74.82 -45.57 42.52 Favored 'General case' 0 C--O 1.223 -0.294 0 C-N-CA 125.612 1.565 . . . . 0.0 110.687 178.766 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 44' ' ' TYR . . . . . . . . . . . . . 4.1 t80 -55.89 -41.07 73.91 Favored 'General case' 0 CA--C 1.537 0.444 0 CA-C-N 119.158 0.89 . . . . 0.0 109.42 179.527 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 45' ' ' ILE . . . . . . . . . . . . . 13.2 mm -57.63 -64.31 0.55 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.37 0 CA-C-N 118.847 0.749 . . . . 0.0 109.763 178.897 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 46' ' ' ARG . . . . . . . . . . . . . 12.8 ptp180 -56.0 -46.53 78.71 Favored 'General case' 0 C--O 1.219 -0.508 0 CA-C-O 118.257 -0.878 . . . . 0.0 111.368 -179.15 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 47' ' ' ASN . . . . . . . . . . . . . 35.3 t30 -54.69 -54.43 41.92 Favored 'General case' 0 N--CA 1.452 -0.33 0 CA-C-N 118.989 0.813 . . . . 0.0 110.678 -179.557 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -64.13 -29.58 70.69 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 123.82 0.848 . . . . 0.0 112.35 -179.955 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 49' ' ' ALA . . . . . . . . . . . . . . . -78.75 -14.82 59.07 Favored 'General case' 0 CA--C 1.53 0.186 0 C-N-CA 124.372 1.069 . . . . 0.0 113.277 -179.557 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 11.8 mt -112.83 -35.4 5.48 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-N 119.241 0.928 . . . . 0.0 113.15 -179.264 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 51' ' ' ASN . . . . . . . . . . . . . 70.3 m-80 . . . . . 0 CA--C 1.5 -0.978 0 CA-C-O 116.339 -1.791 . . . . 0.0 112.279 -177.503 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 14.9 m . . . . . 0 N--CA 1.47 0.575 0 CA-C-O 120.586 0.231 . . . . 0.0 110.692 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 9.5 t0 -138.35 -172.34 3.26 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 127.033 2.133 . . . . 0.0 107.908 179.511 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 75.1 m -128.49 170.83 12.7 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-N 120.675 1.579 . . . . 0.0 110.99 179.469 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -74.18 -14.85 61.01 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 123.859 0.864 . . . . 0.0 112.125 179.517 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 12.5 m -130.67 121.27 50.03 Favored 'Isoleucine or valine' 0 C--O 1.234 0.284 0 N-CA-C 105.351 -2.092 . . . . 0.0 105.351 178.84 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 11.5 tpt180 -85.2 -55.25 4.13 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-O 118.644 -0.693 . . . . 0.0 110.464 -179.317 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 41.0 pttt 29.98 57.76 0.18 Allowed 'General case' 0 N--CA 1.466 0.374 0 C-N-CA 128.67 2.788 . . . . 0.0 111.681 -178.713 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 13.3 tptm -118.69 108.79 15.33 Favored 'General case' 0 CA--C 1.515 -0.384 0 N-CA-C 104.826 -2.287 . . . . 0.0 104.826 -179.601 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 5.8 p -120.61 173.7 7.03 Favored 'General case' 0 C--N 1.322 -0.597 0 C-N-CA 125.854 1.662 . . . . 0.0 110.99 -177.988 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 27.2 tt0 -76.14 132.18 39.85 Favored 'General case' 0 CA--C 1.535 0.387 0 N-CA-C 104.58 -2.378 . . . . 0.0 104.58 177.911 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 2.5 t -46.25 -41.84 4.55 Favored 'Isoleucine or valine' 0 C--O 1.237 0.437 0 C-N-CA 124.911 1.285 . . . . 0.0 113.357 -177.96 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 21.3 tpp180 -116.01 114.6 24.81 Favored 'General case' 0 C--O 1.235 0.315 0 N-CA-C 106.357 -1.72 . . . . 0.0 106.357 179.466 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 15.7 tt0 -81.16 86.18 6.23 Favored 'General case' 0 CA--C 1.527 0.09 0 N-CA-C 103.932 -2.618 . . . . 0.0 103.932 178.228 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 20.0 ptmt -60.61 -25.97 66.65 Favored 'General case' 0 C--O 1.225 -0.223 0 C-N-CA 123.611 0.764 . . . . 0.0 112.124 -179.101 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 5.8 t -90.0 159.63 16.78 Favored 'General case' 0 N--CA 1.444 -0.754 0 CA-C-O 122.323 1.059 . . . . 0.0 108.803 179.262 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 20.3 t -96.57 145.39 8.85 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.621 0 N-CA-C 104.603 -2.369 . . . . 0.0 104.603 178.062 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 8.0 p -143.38 107.45 1.23 Allowed 'Isoleucine or valine' 0 C--O 1.238 0.485 0 N-CA-C 104.909 -2.256 . . . . 0.0 104.909 178.295 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 10.0 ttt85 -141.94 162.14 36.21 Favored 'General case' 0 C--O 1.237 0.411 0 CA-C-O 121.423 0.63 . . . . 0.0 111.826 -179.251 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 42.0 m -92.12 103.43 15.92 Favored 'General case' 0 N--CA 1.445 -0.7 0 N-CA-C 105.144 -2.169 . . . . 0.0 105.144 179.503 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.457 HD12 ' HA ' ' A' ' 20' ' ' LEU . 18.6 tp -110.58 111.64 22.99 Favored 'General case' 0 C--N 1.323 -0.553 0 C-N-CA 123.931 0.893 . . . . 0.0 108.75 179.836 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 11.5 mmm-85 -94.51 150.96 19.73 Favored 'General case' 0 N--CA 1.451 -0.38 0 C-N-CA 124.637 1.175 . . . . 0.0 109.879 179.785 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 87.2 m-85 -128.82 179.09 5.91 Favored 'General case' 0 C--O 1.237 0.412 0 C-N-CA 125.853 1.661 . . . . 0.0 108.096 178.457 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . 0.485 ' HB3' ' HD2' ' A' ' 24' ' ' PRO . 62.6 m -112.06 173.94 2.59 Favored Pre-proline 0 CA--C 1.543 0.687 0 CA-C-O 117.563 -1.208 . . . . 0.0 109.041 179.853 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . 0.485 ' HD2' ' HB3' ' A' ' 23' ' ' SER . 45.1 Cg_endo -68.51 -48.9 0.96 Allowed 'Trans proline' 0 C--N 1.35 0.617 0 CA-C-N 121.557 1.592 . . . . 0.0 113.478 -177.15 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 20.4 t -66.17 -37.2 79.21 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.432 0 N-CA-C 109.657 -0.498 . . . . 0.0 109.657 -179.499 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 49.8 mt-10 -64.62 -50.86 65.49 Favored 'General case' 0 C--N 1.341 0.212 0 N-CA-C 108.788 -0.819 . . . . 0.0 108.788 179.636 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 6.0 t70 -57.52 -45.34 85.11 Favored 'General case' 0 CA--C 1.513 -0.463 0 C-N-CA 124.972 1.309 . . . . 0.0 110.617 179.642 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -60.51 -46.19 91.06 Favored 'General case' 0 N--CA 1.45 -0.437 0 C-N-CA 123.296 0.638 . . . . 0.0 109.438 179.703 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 27.8 m -60.7 -57.08 14.2 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 123.179 0.592 . . . . 0.0 109.94 179.671 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 40.5 mt -58.03 -43.13 84.43 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.317 0 C-N-CA 124.927 1.291 . . . . 0.0 110.992 -178.815 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 43.5 ttt180 -62.29 -48.2 80.92 Favored 'General case' 0 CA--C 1.516 -0.363 0 C-N-CA 123.359 0.663 . . . . 0.0 110.499 -179.604 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -63.91 -46.11 86.27 Favored 'General case' 0 CA--C 1.518 -0.251 0 C-N-CA 120.659 -0.416 . . . . 0.0 110.09 -178.842 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 8.2 tptm -63.7 -44.63 93.07 Favored 'General case' 0 N--CA 1.455 -0.181 0 CA-C-O 119.615 -0.231 . . . . 0.0 110.993 -179.349 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -59.93 -51.64 68.82 Favored 'General case' 0 N--CA 1.454 -0.254 0 C-N-CA 124.041 0.936 . . . . 0.0 110.579 179.754 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 39.2 tt0 -64.65 -36.66 84.96 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-O 119.113 -0.47 . . . . 0.0 110.829 -179.053 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 27.5 t70 -67.69 -43.98 78.82 Favored 'General case' 0 CA--C 1.518 -0.267 0 C-N-CA 123.954 0.902 . . . . 0.0 109.802 179.147 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 31.2 t -73.23 -14.79 61.4 Favored 'General case' 0 CA--C 1.542 0.663 0 CA-C-O 122.105 0.955 . . . . 0.0 109.645 179.025 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 77.88 8.73 87.26 Favored Glycine 0 N--CA 1.443 -0.894 0 O-C-N 120.542 -1.349 . . . . 0.0 114.829 178.902 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 15.0 mt -114.41 118.36 33.62 Favored 'General case' 0 CA--C 1.515 -0.403 0 N-CA-C 103.742 -2.688 . . . . 0.0 103.742 179.252 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 12.7 t -48.13 158.75 0.23 Allowed 'General case' 0 C--N 1.329 -0.3 0 C-N-CA 124.811 1.244 . . . . 0.0 111.569 -179.292 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 69.7 t -46.06 -44.29 5.23 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.342 0 C-N-CA 125.038 1.335 . . . . 0.0 112.02 -178.885 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 11.8 p -62.72 -41.62 99.25 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-N 120.498 1.499 . . . . 0.0 111.848 -179.994 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -67.71 -49.98 59.87 Favored 'General case' 0 C--O 1.218 -0.569 0 N-CA-C 108.106 -1.072 . . . . 0.0 108.106 178.222 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 45.8 t80 -52.22 -51.38 58.59 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 123.963 0.905 . . . . 0.0 108.647 179.28 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.45 HG23 HG23 ' B' ' 45' ' ' ILE . 6.2 mm -55.61 -62.62 0.76 Allowed 'Isoleucine or valine' 0 C--O 1.225 -0.194 0 C-N-CA 125.704 1.602 . . . . 0.0 110.744 179.608 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 21.4 ptt180 -59.13 -45.7 90.24 Favored 'General case' 0 C--O 1.222 -0.343 0 CA-C-O 119.07 -0.491 . . . . 0.0 111.626 -178.162 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 21.7 t30 -58.25 -52.43 65.59 Favored 'General case' 0 N--CA 1.45 -0.464 0 C-N-CA 124.222 1.009 . . . . 0.0 111.099 -178.905 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -67.97 -25.62 65.53 Favored 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 124.333 1.053 . . . . 0.0 112.148 179.736 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -80.71 -41.97 22.72 Favored 'General case' 0 N--CA 1.454 -0.261 0 CA-C-N 118.428 0.558 . . . . 0.0 111.444 179.699 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 27.9 mt -73.2 -45.11 58.16 Favored 'General case' 0 CA--C 1.516 -0.355 0 C-N-CA 123.561 0.745 . . . . 0.0 111.809 -178.96 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 68.2 m-80 . . . . . 0 C--O 1.251 1.14 0 CA-C-O 116.961 -1.495 . . . . 0.0 111.136 -178.421 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 1' ' ' SER . . . . . . . . . . . . . 10.0 m . . . . . 0 N--CA 1.466 0.353 0 N-CA-C 108.906 -0.776 . . . . 0.0 108.906 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 2' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -121.44 159.63 25.83 Favored 'General case' 0 CA--C 1.514 -0.43 0 CA-C-O 122.187 0.994 . . . . 0.0 110.415 -179.434 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 3' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -92.17 174.31 7.37 Favored 'General case' 0 N--CA 1.443 -0.809 0 C-N-CA 126.834 2.053 . . . . 0.0 107.884 179.062 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 4' ' ' ALA . . . . . . . . . . . . . . . -70.9 -0.56 9.45 Favored 'General case' 0 CA--C 1.545 0.779 0 O-C-N 121.786 -0.571 . . . . 0.0 111.075 178.132 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 35.7 m -141.12 169.69 14.59 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.485 0 C-N-CA 128.014 2.526 . . . . 0.0 108.221 179.63 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 6' ' ' ARG . . . . . . . . . . . . . 11.0 tpt180 -133.39 -59.6 0.86 Allowed 'General case' 0 N--CA 1.462 0.142 0 C-N-CA 124.933 1.293 . . . . 0.0 111.178 -179.363 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 43.9 pttt 35.22 72.58 0.1 Allowed 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 126.975 2.11 . . . . 0.0 113.579 -179.856 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 20.0 tptm -117.81 93.2 4.06 Favored 'General case' 0 N--CA 1.465 0.294 0 O-C-N 121.452 -0.78 . . . . 0.0 111.324 -179.297 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 10.0 p -85.87 -178.1 6.51 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 127.14 2.176 . . . . 0.0 110.133 179.284 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 10' ' ' GLU . . . . . . . . . . . . . 10.1 tt0 -96.52 156.98 16.11 Favored 'General case' 0 CA--C 1.537 0.47 0 N-CA-C 107.613 -1.254 . . . . 0.0 107.613 178.037 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 11' ' ' VAL . . . . . . . . . . . . . 82.0 t -60.48 -67.69 0.29 Allowed 'Isoleucine or valine' 0 C--O 1.237 0.428 0 C-N-CA 124.729 1.211 . . . . 0.0 111.481 -179.078 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 12' ' ' ARG . . . . . . . . . . . . . 7.7 tpp85 -106.67 102.42 11.8 Favored 'General case' 0 CA--C 1.516 -0.35 0 N-CA-C 106.48 -1.674 . . . . 0.0 106.48 179.817 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 13' ' ' GLN . . . . . . . . . . . . . 5.1 tt0 -66.39 103.2 0.98 Allowed 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 106.927 -1.508 . . . . 0.0 106.927 179.3 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 8.2 ptmt -73.32 -23.65 60.28 Favored 'General case' 0 N--CA 1.467 0.383 0 C-N-CA 126.384 1.874 . . . . 0.0 114.925 -178.588 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 13.1 t -81.72 -169.06 2.15 Favored 'General case' 0 N--CA 1.443 -0.822 0 C-N-CA 126.257 1.823 . . . . 0.0 111.428 -178.425 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 2.6 t -143.73 91.22 0.41 Allowed 'Isoleucine or valine' 0 N--CA 1.441 -0.915 0 N-CA-C 103.757 -2.682 . . . . 0.0 103.757 178.378 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 8.1 p -92.27 118.6 38.15 Favored 'Isoleucine or valine' 0 C--O 1.239 0.528 0 N-CA-C 104.332 -2.47 . . . . 0.0 104.332 178.459 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 13.1 ttt85 -145.58 176.57 9.52 Favored 'General case' 0 C--O 1.233 0.229 0 O-C-N 121.432 -0.792 . . . . 0.0 109.732 -178.783 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 25.7 m -114.98 90.19 3.28 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 105.487 -2.042 . . . . 0.0 105.487 -179.546 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -95.06 106.12 18.09 Favored 'General case' 0 C--N 1.324 -0.533 0 C-N-CA 124.474 1.11 . . . . 0.0 108.176 -179.126 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 12.0 mtm180 -91.52 155.9 18.07 Favored 'General case' 0 C--O 1.238 0.467 0 CA-C-N 118.342 0.519 . . . . 0.0 111.357 178.892 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 22' ' ' PHE . . . . . . . . . . . . . 96.8 m-85 -136.44 143.97 44.17 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 107.801 -1.185 . . . . 0.0 107.801 179.796 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -75.21 168.17 30.07 Favored Pre-proline 0 CA--C 1.543 0.694 0 C-N-CA 123.555 0.742 . . . . 0.0 109.888 179.45 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 24' ' ' PRO . . . . . . . . . . . . . 34.2 Cg_endo -61.35 -40.83 45.91 Favored 'Trans proline' 0 C--N 1.348 0.541 0 C-N-CA 122.808 2.338 . . . . 0.0 113.283 -177.921 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 25' ' ' VAL . . . . . . . . . . . . . 38.5 t -72.15 -33.57 47.16 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.491 0 N-CA-C 109.271 -0.64 . . . . 0.0 109.271 179.562 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 68.6 mt-10 -65.94 -46.07 79.53 Favored 'General case' 0 C--N 1.343 0.316 0 N-CA-C 107.802 -1.184 . . . . 0.0 107.802 178.722 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 27' ' ' ASP . . . . . . . . . . . . . 4.0 t0 -58.9 -48.71 80.48 Favored 'General case' 0 CA--C 1.512 -0.494 0 C-N-CA 127.022 2.129 . . . . 0.0 110.075 179.216 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 28' ' ' GLU . . . . . . . . . . . . . 71.8 tt0 -56.38 -51.03 69.83 Favored 'General case' 0 N--CA 1.455 -0.204 0 CA-C-N 118.892 0.769 . . . . 0.0 109.874 179.53 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 60.8 m -60.94 -56.6 19.21 Favored 'General case' 0 N--CA 1.451 -0.422 0 C-N-CA 122.591 0.356 . . . . 0.0 110.934 -178.846 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 97.8 mt -57.26 -49.87 78.5 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.477 0 C-N-CA 123.001 0.52 . . . . 0.0 111.091 -178.57 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 53.2 ttt180 -59.84 -44.82 93.87 Favored 'General case' 0 CA--C 1.521 -0.171 0 CA-C-N 119.143 0.883 . . . . 0.0 111.284 -179.462 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.42 -45.48 87.39 Favored 'General case' 0 CA--C 1.51 -0.596 0 CA-C-O 118.765 -0.636 . . . . 0.0 110.693 -178.927 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 17.9 tptm -67.26 -46.96 72.13 Favored 'General case' 0 N--CA 1.453 -0.277 0 N-CA-C 109.61 -0.515 . . . . 0.0 109.61 -179.351 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 34' ' ' ALA . . . . . . . . . . . . . . . -56.86 -54.79 42.43 Favored 'General case' 0 N--CA 1.453 -0.292 0 C-N-CA 125.318 1.447 . . . . 0.0 112.693 -179.705 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 5.4 tt0 -70.2 -26.71 64.01 Favored 'General case' 0 C--O 1.233 0.235 0 N-CA-C 112.205 0.446 . . . . 0.0 112.205 -177.372 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 36' ' ' ASP . . . . . . . . . . . . . 15.0 t70 -75.04 -42.54 56.94 Favored 'General case' 0 C--N 1.331 -0.236 0 O-C-N 121.553 -0.717 . . . . 0.0 109.091 178.255 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 37' ' ' SER . . . . . . . . . . . . . 39.6 t -69.83 -23.81 63.36 Favored 'General case' 0 C--O 1.235 0.324 0 C-N-CA 126.017 1.727 . . . . 0.0 111.32 -179.812 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 81.09 23.18 59.65 Favored Glycine 0 CA--C 1.53 0.997 0 N-CA-C 110.355 -1.098 . . . . 0.0 110.355 -178.689 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 39' ' ' LEU . . . . . . . . . . . . . 57.8 mt -120.68 95.08 4.57 Favored 'General case' 0 N--CA 1.447 -0.62 1 N-CA-C 99.827 -4.138 . . . . 0.0 99.827 178.446 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 40' ' ' THR . . . . . . . . . . . . . 4.6 t -48.82 158.83 0.28 Allowed 'General case' 0 N--CA 1.457 -0.102 0 C-N-CA 122.783 0.433 . . . . 0.0 110.358 -178.952 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 41' ' ' VAL . . . . . . . . . . . . . 97.9 t -41.49 -47.9 0.83 Allowed 'Isoleucine or valine' 0 N--CA 1.447 -0.601 0 C-N-CA 124.221 1.008 . . . . 0.0 112.914 -176.828 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 42' ' ' SER . . . . . . . . . . . . . 2.5 p -65.43 -45.75 82.62 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 117.694 -1.603 . . . . 0.0 112.701 -179.403 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -61.02 -45.3 95.37 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 125.346 1.458 . . . . 0.0 110.389 179.225 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 44' ' ' TYR . . . . . . . . . . . . . 9.8 t80 -60.44 -46.29 90.57 Favored 'General case' 0 C--O 1.222 -0.342 0 C-N-CA 123.768 0.827 . . . . 0.0 109.861 179.456 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 45' ' ' ILE . . . . . 0.45 HG23 HG23 ' A' ' 45' ' ' ILE . 19.0 mm -57.67 -61.51 1.28 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.355 0 CA-C-N 119.656 1.116 . . . . 0.0 110.228 179.689 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 46' ' ' ARG . . . . . . . . . . . . . 21.7 ptt180 -53.65 -47.51 70.28 Favored 'General case' 0 CA--C 1.528 0.133 0 CA-C-O 119.373 -0.346 . . . . 0.0 111.641 -178.792 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 47' ' ' ASN . . . . . . . . . . . . . 41.9 t30 -64.33 -49.67 70.82 Favored 'General case' 0 C--O 1.234 0.286 0 N-CA-C 114.117 1.154 . . . . 0.0 114.117 -178.989 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -68.1 -21.31 64.97 Favored 'General case' 0 C--O 1.23 0.069 0 C-N-CA 124.19 0.996 . . . . 0.0 112.365 -179.344 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 49' ' ' ALA . . . . . . . . . . . . . . . -87.19 -40.3 14.7 Favored 'General case' 0 N--CA 1.451 -0.404 0 CA-C-N 118.587 0.63 . . . . 0.0 110.975 179.719 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 39.4 mt -68.29 -48.69 64.32 Favored 'General case' 0 C--O 1.233 0.208 0 O-C-N 121.612 -0.68 . . . . 0.0 112.834 -179.055 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 51' ' ' ASN . . . . . . . . . . . . . 44.2 m-80 . . . . . 0 C--O 1.247 0.922 0 CA-C-O 117.445 -1.264 . . . . 0.0 112.565 -177.026 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 1.1 t . . . . . 0 N--CA 1.472 0.64 0 N-CA-C 107.222 -1.399 . . . . 0.0 107.222 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 40.1 t0 -145.34 77.65 1.52 Allowed 'General case' 0 N--CA 1.466 0.325 0 CA-C-O 122.913 1.339 . . . . 0.0 108.415 -179.57 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 2.1 m -67.23 10.09 0.18 Allowed 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 127.743 2.417 . . . . 0.0 115.741 -178.854 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -66.83 102.83 1.0 Allowed 'General case' 0 CA--C 1.534 0.336 0 CA-C-N 120.649 1.568 . . . . 0.0 110.998 -179.42 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 41.2 t -77.32 86.17 0.89 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.39 0 C-N-CA 124.36 1.064 . . . . 0.0 109.138 179.576 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 5.1 ptp85 -78.17 -45.5 23.0 Favored 'General case' 0 C--N 1.332 -0.175 0 O-C-N 121.104 -0.998 . . . . 0.0 108.48 178.332 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 5.3 mptp? -82.94 100.46 10.42 Favored 'General case' 0 N--CA 1.455 -0.192 0 C-N-CA 125.37 1.468 . . . . 0.0 108.578 179.814 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 13.3 mptt -80.88 -66.47 0.88 Allowed 'General case' 0 N--CA 1.468 0.429 0 N-CA-C 105.74 -1.948 . . . . 0.0 105.74 178.71 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 54.3 p -155.67 162.32 40.61 Favored 'General case' 0 C--O 1.242 0.698 0 N-CA-C 105.22 -2.141 . . . . 0.0 105.22 177.599 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 19.4 pt-20 -123.72 3.49 8.88 Favored 'General case' 0 N--CA 1.467 0.388 0 N-CA-C 113.652 0.982 . . . . 0.0 113.652 -179.701 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 38.4 t -66.87 -51.6 53.53 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.405 0 C-N-CA 124.407 1.083 . . . . 0.0 111.329 -179.341 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 16.6 mtm180 -67.69 167.15 13.74 Favored 'General case' 0 N--CA 1.466 0.344 0 N-CA-C 112.88 0.696 . . . . 0.0 112.88 -178.788 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 57.6 mt-30 -86.24 139.74 30.76 Favored 'General case' 0 N--CA 1.448 -0.546 0 N-CA-C 105.552 -2.018 . . . . 0.0 105.552 177.589 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 21.6 ptmt -128.18 -31.05 2.37 Favored 'General case' 0 C--N 1.326 -0.426 0 C-N-CA 126.23 1.812 . . . . 0.0 107.71 178.455 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 3.2 t -72.92 -177.31 2.34 Favored 'General case' 0 N--CA 1.445 -0.687 0 N-CA-C 107.12 -1.437 . . . . 0.0 107.12 177.152 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.401 HG21 ' CG ' ' B' ' 27' ' ' ASP . 3.7 t -131.62 144.3 37.86 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 N-CA-C 106.038 -1.838 . . . . 0.0 106.038 178.435 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 9.4 p -135.61 103.53 4.01 Favored 'Isoleucine or valine' 0 C--O 1.238 0.487 0 N-CA-C 105.931 -1.877 . . . . 0.0 105.931 179.49 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 30.9 ttm180 -139.27 151.09 46.19 Favored 'General case' 0 CA--C 1.514 -0.438 0 CA-C-N 115.005 -0.998 . . . . 0.0 109.516 -179.706 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 19.4 m -103.05 144.6 31.08 Favored 'General case' 0 N--CA 1.449 -0.507 0 N-CA-C 107.344 -1.354 . . . . 0.0 107.344 -179.845 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 54.4 mt -133.32 142.33 48.4 Favored 'General case' 0 C--O 1.236 0.353 0 CA-C-O 121.902 0.858 . . . . 0.0 109.334 179.44 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 10.8 mmt85 -102.18 141.59 34.78 Favored 'General case' 0 N--CA 1.451 -0.389 0 C-N-CA 126.707 2.003 . . . . 0.0 106.809 178.898 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 95.0 m-85 -140.6 143.58 35.33 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 105.418 -2.067 . . . . 0.0 105.418 179.342 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 1.7 m -78.72 165.28 50.61 Favored Pre-proline 0 CA--C 1.539 0.526 0 N-CA-C 108.298 -1.001 . . . . 0.0 108.298 179.851 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -67.5 -21.14 46.86 Favored 'Trans proline' 0 CA--C 1.535 0.539 0 C-N-CA 122.018 1.812 . . . . 0.0 112.107 -179.642 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 16.0 t -82.89 -20.87 9.35 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.409 0 C-N-CA 125.07 1.348 . . . . 0.0 110.687 -179.686 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 93.6 mt-10 -92.61 -46.64 7.5 Favored 'General case' 0 CA--C 1.531 0.23 0 N-CA-C 107.047 -1.464 . . . . 0.0 107.047 178.782 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 2.9 t70 -55.69 -52.7 62.97 Favored 'General case' 0 CA--C 1.507 -0.693 0 C-N-CA 128.601 2.76 . . . . 0.0 112.817 179.792 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -60.99 -38.66 86.79 Favored 'General case' 0 N--CA 1.45 -0.447 0 C-N-CA 119.451 -0.9 . . . . 0.0 110.209 -178.508 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 89.5 m -64.96 -53.01 53.0 Favored 'General case' 0 N--CA 1.451 -0.376 0 CA-C-O 118.83 -0.605 . . . . 0.0 109.628 179.015 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 78.2 mt -56.57 -43.7 79.14 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.203 0 N-CA-C 109.06 -0.718 . . . . 0.0 109.06 -179.708 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 55.2 ttt180 -61.82 -50.6 71.66 Favored 'General case' 0 N--CA 1.455 -0.2 0 C-N-CA 123.734 0.814 . . . . 0.0 110.792 179.402 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 2.4 mptm? -61.86 -46.81 87.84 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-N 118.747 0.703 . . . . 0.0 110.257 -179.101 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 26.0 mmtp -63.74 -45.01 91.83 Favored 'General case' 0 C--O 1.227 -0.124 0 CA-C-N 118.655 0.661 . . . . 0.0 110.322 -179.799 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -60.57 -46.55 89.79 Favored 'General case' 0 C--O 1.237 0.413 0 C-N-CA 123.733 0.813 . . . . 0.0 110.424 179.753 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 27.7 tt0 -67.14 -39.65 86.62 Favored 'General case' 0 N--CA 1.454 -0.263 0 O-C-N 121.849 -0.532 . . . . 0.0 110.815 -179.564 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -67.58 -44.27 78.55 Favored 'General case' 0 N--CA 1.456 -0.168 0 O-C-N 121.747 -0.596 . . . . 0.0 110.347 -179.999 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 6.8 t -69.53 -17.29 63.57 Favored 'General case' 0 N--CA 1.449 -0.516 0 C-N-CA 124.553 1.141 . . . . 0.0 111.764 -178.602 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 75.43 26.42 65.76 Favored Glycine 0 CA--C 1.53 1.001 0 CA-C-N 118.853 0.751 . . . . 0.0 111.353 -179.969 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 88.6 mt -127.78 114.21 16.96 Favored 'General case' 0 N--CA 1.454 -0.233 0 C-N-CA 127.46 2.304 . . . . 0.0 105.517 179.902 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 9.4 t -52.22 154.9 2.16 Favored 'General case' 0 CA--C 1.536 0.421 0 CA-C-N 119.397 0.998 . . . . 0.0 109.664 179.747 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 53.6 t -46.78 -41.95 5.54 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.311 0 C-N-CA 125.407 1.483 . . . . 0.0 112.011 -179.052 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 7.1 p -63.86 -48.84 75.12 Favored 'General case' 0 CA--C 1.541 0.599 0 CA-C-N 119.599 1.09 . . . . 0.0 110.822 179.557 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -62.2 -45.56 92.84 Favored 'General case' 0 C--O 1.223 -0.293 0 C-N-CA 124.837 1.255 . . . . 0.0 109.509 178.621 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 71.6 t80 -54.92 -50.38 68.96 Favored 'General case' 0 N--CA 1.452 -0.351 0 C-N-CA 125.056 1.343 . . . . 0.0 108.802 179.308 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 8.3 mm -56.44 -63.59 0.6 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.316 0 C-N-CA 124.229 1.012 . . . . 0.0 110.505 179.406 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 25.8 ptt180 -55.53 -41.47 73.2 Favored 'General case' 0 N--CA 1.466 0.333 0 O-C-N 121.607 -0.683 . . . . 0.0 111.807 -178.657 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 22.2 t30 -60.81 -53.47 56.93 Favored 'General case' 0 N--CA 1.453 -0.321 0 C-N-CA 123.81 0.844 . . . . 0.0 110.944 179.803 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -63.82 -32.02 73.39 Favored 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 123.532 0.733 . . . . 0.0 112.375 -179.58 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -73.06 -28.73 62.48 Favored 'General case' 0 CA--C 1.531 0.222 0 N-CA-C 113.366 0.876 . . . . 0.0 113.366 -179.317 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 19.2 mt -92.23 -34.74 14.15 Favored 'General case' 0 C--O 1.236 0.381 0 O-C-N 121.912 -0.493 . . . . 0.0 110.758 -179.592 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 28.8 m-80 . . . . . 0 C--O 1.249 1.044 0 C-N-CA 124.438 1.095 . . . . 0.0 108.848 179.896 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 1' ' ' SER . . . . . . . . . . . . . 14.8 m . . . . . 0 N--CA 1.467 0.404 0 N-CA-C 108.165 -1.05 . . . . 0.0 108.165 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 2' ' ' ASP . . . . . . . . . . . . . 16.5 t0 -145.72 152.47 39.64 Favored 'General case' 0 C--O 1.234 0.24 0 N-CA-C 105.707 -1.96 . . . . 0.0 105.707 179.645 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 3' ' ' SER . . . . . . . . . . . . . 13.1 m -137.96 10.98 2.86 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 126.625 1.97 . . . . 0.0 110.386 -179.591 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 4' ' ' ALA . . . . . . . . . . . . . . . -70.54 72.94 0.52 Allowed 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 125.461 1.504 . . . . 0.0 112.895 -179.821 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 97.3 t -72.54 145.23 12.21 Favored 'Isoleucine or valine' 0 C--O 1.238 0.492 0 N-CA-C 105.055 -2.202 . . . . 0.0 105.055 177.544 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 6' ' ' ARG . . . . . . . . . . . . . 40.5 mtp85 -135.26 -54.26 0.79 Allowed 'General case' 0 N--CA 1.467 0.423 0 O-C-N 121.312 -0.868 . . . . 0.0 112.039 -179.26 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 32.1 mmtp -73.43 84.54 1.48 Allowed 'General case' 0 CA--C 1.529 0.163 0 C-N-CA 124.176 0.99 . . . . 0.0 111.609 -178.798 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 14.2 mptt -47.6 -63.88 0.93 Allowed 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 125.055 1.342 . . . . 0.0 109.79 179.087 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 72.4 p -153.09 -178.42 6.93 Favored 'General case' 0 N--CA 1.444 -0.753 0 C-N-CA 126.11 1.764 . . . . 0.0 107.727 -179.364 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 10' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -134.03 4.82 3.54 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 124.274 1.03 . . . . 0.0 112.259 178.363 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 11' ' ' VAL . . . . . . . . . . . . . 72.6 t -71.98 -55.89 11.94 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.239 0 N-CA-C 108.2 -1.037 . . . . 0.0 108.2 179.287 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 12' ' ' ARG . . . . . . . . . . . . . 9.8 mmm180 -54.2 129.16 34.0 Favored 'General case' 0 C--O 1.237 0.425 0 C-N-CA 126.469 1.908 . . . . 0.0 110.177 -178.857 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 13' ' ' GLN . . . . . . . . . . . . . 1.2 pt20 -75.85 96.09 3.63 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 105.294 -2.113 . . . . 0.0 105.294 178.01 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 17.9 ptmt -81.26 -29.74 34.3 Favored 'General case' 0 C--N 1.331 -0.202 0 C-N-CA 123.425 0.69 . . . . 0.0 111.986 -179.348 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 1.9 t -72.01 165.65 23.82 Favored 'General case' 0 N--CA 1.444 -0.747 0 N-CA-C 107.717 -1.216 . . . . 0.0 107.717 178.563 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 38.9 t -108.38 153.89 9.81 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.687 0 N-CA-C 105.884 -1.895 . . . . 0.0 105.884 178.332 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 9.8 p -150.24 103.48 0.33 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.555 0 N-CA-C 107.826 -1.176 . . . . 0.0 107.826 178.885 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 15.7 ttm180 -146.55 152.75 39.46 Favored 'General case' 0 C--N 1.328 -0.344 0 O-C-N 121.355 -0.84 . . . . 0.0 109.783 -179.932 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 7.1 m -96.72 140.08 31.83 Favored 'General case' 0 N--CA 1.448 -0.529 0 C-N-CA 125.446 1.498 . . . . 0.0 108.169 179.322 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 95.0 mt -123.06 165.73 16.31 Favored 'General case' 0 C--O 1.236 0.38 0 N-CA-C 106.965 -1.494 . . . . 0.0 106.965 178.213 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 1.9 mmt85 -125.22 143.92 50.71 Favored 'General case' 0 C--O 1.239 0.525 0 C-N-CA 126.565 1.946 . . . . 0.0 108.34 179.531 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 22' ' ' PHE . . . . . . . . . . . . . 97.4 m-85 -141.41 141.9 33.74 Favored 'General case' 0 CA--C 1.516 -0.347 0 N-CA-C 105.407 -2.071 . . . . 0.0 105.407 179.75 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 4.9 m -79.75 165.0 50.47 Favored Pre-proline 0 C--N 1.324 -0.531 0 CA-C-O 118.432 -0.794 . . . . 0.0 109.171 -179.482 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 24' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -67.27 -5.32 13.55 Favored 'Trans proline' 0 CA--C 1.537 0.645 0 C-N-CA 122.9 2.4 . . . . 0.0 113.165 179.811 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 25' ' ' VAL . . . . . . . . . . . . . 55.4 t -93.85 -61.75 1.99 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.487 0 N-CA-C 104.934 -2.247 . . . . 0.0 104.934 178.713 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 63.6 mt-10 -53.84 -48.12 70.28 Favored 'General case' 0 N--CA 1.455 -0.217 0 C-N-CA 126.186 1.795 . . . . 0.0 110.961 -179.528 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 27' ' ' ASP . . . . . 0.401 ' CG ' HG21 ' A' ' 16' ' ' VAL . 15.5 t70 -61.25 -50.68 72.08 Favored 'General case' 0 CA--C 1.511 -0.526 0 C-N-CA 124.81 1.244 . . . . 0.0 112.048 -179.841 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 28' ' ' GLU . . . . . . . . . . . . . 5.4 tp10 -60.26 -43.57 96.04 Favored 'General case' 0 N--CA 1.449 -0.478 0 N-CA-C 108.645 -0.872 . . . . 0.0 108.645 -179.318 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 53.4 m -59.37 -54.36 47.59 Favored 'General case' 0 N--CA 1.452 -0.339 0 N-CA-C 108.731 -0.84 . . . . 0.0 108.731 178.902 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 71.3 mt -58.53 -43.96 88.15 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.317 0 C-N-CA 123.194 0.597 . . . . 0.0 110.191 -179.524 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 31.5 ttt180 -56.3 -49.44 74.29 Favored 'General case' 0 C--N 1.333 -0.147 0 C-N-CA 123.929 0.891 . . . . 0.0 109.624 179.711 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 1.4 mptm? -67.4 -43.07 82.21 Favored 'General case' 0 C--O 1.223 -0.309 0 CA-C-O 117.758 -1.115 . . . . 0.0 110.757 -179.572 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 29.3 mmtp -63.11 -44.14 96.49 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-N 119.842 1.201 . . . . 0.0 110.665 -179.559 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 34' ' ' ALA . . . . . . . . . . . . . . . -59.32 -56.6 20.02 Favored 'General case' 0 N--CA 1.451 -0.423 0 C-N-CA 124.8 1.24 . . . . 0.0 109.158 179.63 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -61.77 -37.94 86.18 Favored 'General case' 0 C--O 1.236 0.364 0 C-N-CA 123.389 0.676 . . . . 0.0 112.024 -178.688 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 36' ' ' ASP . . . . . . . . . . . . . 9.3 t70 -64.54 -40.7 96.08 Favored 'General case' 0 C--N 1.332 -0.153 0 C-N-CA 125.337 1.455 . . . . 0.0 108.655 178.785 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 37' ' ' SER . . . . . . . . . . . . . 6.2 t -77.78 -8.36 57.9 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 123.738 0.815 . . . . 0.0 110.453 179.013 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 69.45 24.17 76.22 Favored Glycine 0 CA--C 1.531 1.041 0 O-C-N 121.053 -1.029 . . . . 0.0 110.733 -178.991 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 39' ' ' LEU . . . . . . . . . . . . . 71.7 mt -115.99 128.07 55.44 Favored 'General case' 0 N--CA 1.447 -0.595 0 C-N-CA 126.313 1.845 . . . . 0.0 107.399 -179.239 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 40' ' ' THR . . . . . . . . . . . . . 3.5 t -57.31 145.28 32.69 Favored 'General case' 0 CA--C 1.538 0.51 0 N-CA-C 106.717 -1.586 . . . . 0.0 106.717 177.747 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 41' ' ' VAL . . . . . . . . . . . . . 94.1 t -49.8 -41.09 16.63 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.28 0 O-C-N 120.772 -1.205 . . . . 0.0 112.106 -178.735 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 42' ' ' SER . . . . . . . . . . . . . 11.3 m -61.64 -40.75 96.0 Favored 'General case' 0 CA--C 1.541 0.61 0 CA-C-N 119.768 1.167 . . . . 0.0 111.373 -179.648 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -68.59 -44.09 75.08 Favored 'General case' 0 C--O 1.22 -0.477 0 C-N-CA 124.389 1.076 . . . . 0.0 108.097 178.13 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 44' ' ' TYR . . . . . . . . . . . . . 70.6 t80 -55.22 -51.99 64.81 Favored 'General case' 0 N--CA 1.454 -0.254 0 N-CA-C 108.726 -0.842 . . . . 0.0 108.726 179.393 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 45' ' ' ILE . . . . . . . . . . . . . 19.3 mm -53.24 -64.65 0.38 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.23 0 C-N-CA 124.328 1.051 . . . . 0.0 111.47 179.545 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 46' ' ' ARG . . . . . . . . . . . . . 27.1 ptt180 -58.11 -42.06 84.92 Favored 'General case' 0 C--O 1.223 -0.331 0 CA-C-O 118.745 -0.645 . . . . 0.0 111.716 -177.978 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 47' ' ' ASN . . . . . . . . . . . . . 43.8 t30 -60.92 -54.84 40.16 Favored 'General case' 0 N--CA 1.45 -0.474 0 CA-C-O 118.655 -0.688 . . . . 0.0 110.216 -179.72 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -58.78 -31.31 68.27 Favored 'General case' 0 CA--C 1.53 0.201 0 C-N-CA 124.03 0.932 . . . . 0.0 111.56 -179.783 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 49' ' ' ALA . . . . . . . . . . . . . . . -74.86 -20.89 59.55 Favored 'General case' 0 N--CA 1.454 -0.273 0 N-CA-C 113.267 0.84 . . . . 0.0 113.267 -179.708 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 11.8 mt -107.91 -29.02 9.27 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 119.417 1.008 . . . . 0.0 111.592 -179.41 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 51' ' ' ASN . . . . . . . . . . . . . 73.0 m-20 . . . . . 0 C--O 1.245 0.855 0 C-N-CA 126.41 1.884 . . . . 0.0 109.817 -178.99 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 15.2 t . . . . . 0 N--CA 1.474 0.747 0 N-CA-C 107.27 -1.382 . . . . 0.0 107.27 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 12.3 p-10 -99.56 -21.14 16.03 Favored 'General case' 0 C--N 1.327 -0.382 0 C-N-CA 127.168 2.187 . . . . 0.0 112.514 -179.339 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 29.7 t -140.71 146.78 38.23 Favored 'General case' 0 N--CA 1.449 -0.506 0 N-CA-C 106.373 -1.714 . . . . 0.0 106.373 -179.444 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -63.21 150.94 41.79 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-O 121.285 0.564 . . . . 0.0 109.517 179.603 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 13.5 p -69.86 -25.75 28.83 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.601 0 O-C-N 122.094 -0.379 . . . . 0.0 110.58 179.705 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 70.5 mtp180 -106.25 133.74 50.48 Favored 'General case' 0 C--N 1.338 0.097 0 N-CA-C 106.772 -1.566 . . . . 0.0 106.772 179.122 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 21.2 pttp -149.1 -51.6 0.16 Allowed 'General case' 0 C--N 1.332 -0.191 0 C-N-CA 124.946 1.298 . . . . 0.0 109.012 179.416 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 15.5 mmtp -71.68 101.25 2.5 Favored 'General case' 0 C--O 1.234 0.253 0 N-CA-C 106.864 -1.532 . . . . 0.0 106.864 178.639 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 52.1 m -166.34 143.02 4.97 Favored 'General case' 0 C--O 1.235 0.341 0 C-N-CA 124.86 1.264 . . . . 0.0 109.329 178.58 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER 178.19 157.23 0.43 Allowed 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 128.915 2.886 . . . . 0.0 107.906 178.643 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 7.8 p -128.52 -22.09 1.58 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.422 0 C-N-CA 124.892 1.277 . . . . 0.0 111.775 -179.792 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 32.7 mtt85 -148.3 126.77 12.36 Favored 'General case' 0 N--CA 1.45 -0.437 0 N-CA-C 105.715 -1.957 . . . . 0.0 105.715 179.779 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 66.1 mt-30 -59.54 98.46 0.05 OUTLIER 'General case' 0 C--N 1.331 -0.226 0 C-N-CA 124.515 1.126 . . . . 0.0 109.013 -179.715 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 19.4 ptmt -77.76 -34.93 52.22 Favored 'General case' 0 N--CA 1.464 0.259 0 C-N-CA 123.001 0.52 . . . . 0.0 110.696 179.714 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 4.3 t -64.17 164.38 11.0 Favored 'General case' 0 N--CA 1.445 -0.691 0 C-N-CA 123.785 0.834 . . . . 0.0 109.409 179.227 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.424 HG21 ' HB2' ' B' ' 27' ' ' ASP . 1.4 t -125.62 102.76 10.8 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.457 0 C-N-CA 123.562 0.745 . . . . 0.0 110.187 -177.9 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 3.1 p -101.25 127.51 54.45 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.412 0 C-N-CA 124.133 0.973 . . . . 0.0 110.872 -178.035 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 14.8 ttm180 -154.66 160.92 41.71 Favored 'General case' 0 C--O 1.237 0.399 0 N-CA-C 108.771 -0.826 . . . . 0.0 108.771 178.045 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 7.1 m -90.76 91.61 8.45 Favored 'General case' 0 C--O 1.237 0.401 0 N-CA-C 107.473 -1.306 . . . . 0.0 107.473 179.565 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -97.84 100.78 12.15 Favored 'General case' 0 C--O 1.236 0.393 0 N-CA-C 107.568 -1.271 . . . . 0.0 107.568 179.147 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 32.9 mtt180 -87.57 159.03 18.75 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 108.992 -0.744 . . . . 0.0 108.992 179.585 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 86.0 m-85 -136.58 152.02 50.01 Favored 'General case' 0 CA--C 1.511 -0.535 0 N-CA-C 108.151 -1.055 . . . . 0.0 108.151 -179.765 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -82.88 171.83 10.84 Favored Pre-proline 0 CA--C 1.539 0.525 0 N-CA-C 107.48 -1.304 . . . . 0.0 107.48 179.664 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -67.24 -37.26 18.68 Favored 'Trans proline' 0 N--CA 1.457 -0.66 0 C-N-CA 121.483 1.455 . . . . 0.0 112.712 -178.473 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 92.3 t -66.58 -53.06 39.2 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.324 0 N-CA-C 107.825 -1.176 . . . . 0.0 107.825 179.508 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 -57.84 -47.24 83.25 Favored 'General case' 0 N--CA 1.455 -0.182 0 C-N-CA 122.941 0.496 . . . . 0.0 110.443 179.576 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 21.7 t70 -59.54 -52.27 66.29 Favored 'General case' 0 CA--C 1.507 -0.676 0 C-N-CA 123.147 0.579 . . . . 0.0 111.257 -179.979 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -56.1 -38.54 70.89 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 118.351 0.523 . . . . 0.0 110.594 -179.456 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 25.9 m -67.05 -56.48 9.9 Favored 'General case' 0 N--CA 1.449 -0.495 0 C-N-CA 123.359 0.664 . . . . 0.0 109.874 179.527 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 88.2 mt -60.16 -38.89 78.85 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.252 0 C-N-CA 123.834 0.854 . . . . 0.0 109.758 -179.394 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 64.4 ttt180 -61.86 -51.72 67.05 Favored 'General case' 0 C--O 1.223 -0.293 0 C-N-CA 124.857 1.263 . . . . 0.0 108.341 179.217 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 2.6 mptp? -59.42 -48.97 79.61 Favored 'General case' 0 CA--C 1.515 -0.381 0 C-N-CA 123.305 0.642 . . . . 0.0 109.529 179.78 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 64.4 mmtt -60.88 -45.72 93.47 Favored 'General case' 0 CA--C 1.509 -0.626 0 CA-C-O 118.565 -0.731 . . . . 0.0 111.871 -178.943 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -63.41 -53.71 48.12 Favored 'General case' 0 N--CA 1.446 -0.665 0 O-C-N 123.595 0.559 . . . . 0.0 110.161 -179.256 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -61.13 -36.88 80.91 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 123.378 0.671 . . . . 0.0 111.824 -177.866 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -73.41 -33.77 65.13 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 125.331 1.452 . . . . 0.0 109.696 178.752 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 30.0 t -72.71 -13.69 61.4 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 125.079 1.352 . . . . 0.0 108.09 177.55 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 82.95 -9.88 59.06 Favored Glycine 0 C--N 1.338 0.694 0 C-N-CA 125.639 1.59 . . . . 0.0 111.784 -179.01 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 82.6 mt -86.3 173.25 9.86 Favored 'General case' 0 N--CA 1.439 -0.98 0 C-N-CA 126.0 1.72 . . . . 0.0 107.222 179.745 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -96.51 157.09 16.06 Favored 'General case' 0 C--N 1.317 -0.844 0 N-CA-C 104.548 -2.389 . . . . 0.0 104.548 177.362 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 84.3 t -51.01 -40.9 21.51 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.382 0 C-N-CA 123.635 0.774 . . . . 0.0 109.503 178.731 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 10.5 p -60.99 -45.05 96.35 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-N 120.428 1.467 . . . . 0.0 112.012 -179.652 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -66.68 -48.39 69.47 Favored 'General case' 0 C--O 1.225 -0.185 0 C-N-CA 123.973 0.909 . . . . 0.0 109.523 179.104 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 87.9 t80 -56.52 -47.13 80.01 Favored 'General case' 0 CA--C 1.538 0.503 0 N-CA-C 109.584 -0.524 . . . . 0.0 109.584 179.819 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 5.9 mm -54.58 -64.45 0.44 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.357 0 C-N-CA 124.896 1.278 . . . . 0.0 110.592 179.477 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 13.1 ptm180 -56.08 -45.06 79.49 Favored 'General case' 0 C--O 1.219 -0.5 0 CA-C-O 118.97 -0.538 . . . . 0.0 110.889 -178.744 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 43.0 t30 -59.28 -54.91 41.45 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-N 118.405 0.548 . . . . 0.0 111.901 -179.299 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -61.81 -29.93 70.48 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 123.813 0.845 . . . . 0.0 111.596 -179.603 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -75.0 -23.06 58.18 Favored 'General case' 0 C--O 1.223 -0.291 0 N-CA-C 113.615 0.969 . . . . 0.0 113.615 179.84 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 6.9 mt -99.93 -39.1 8.33 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 119.62 1.1 . . . . 0.0 112.174 -178.643 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 22.0 m-80 . . . . . 0 C--O 1.254 1.325 0 CA-C-O 116.329 -1.796 . . . . 0.0 113.187 -178.817 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 1' ' ' SER . . . . . . . . . . . . . 1.2 t . . . . . 0 N--CA 1.47 0.542 0 N-CA-C 105.311 -2.107 . . . . 0.0 105.311 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 2' ' ' ASP . . . . . . . . . . . . . 5.6 p-10 -146.33 -45.79 0.19 Allowed 'General case' 0 C--N 1.327 -0.408 0 O-C-N 124.313 1.008 . . . . 0.0 109.808 -178.446 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 3' ' ' SER . . . . . . . . . . . . . 4.4 t -136.51 153.5 51.0 Favored 'General case' 0 N--CA 1.448 -0.525 0 N-CA-C 108.698 -0.853 . . . . 0.0 108.698 -179.583 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 4' ' ' ALA . . . . . . . . . . . . . . . -61.64 141.84 57.55 Favored 'General case' 0 C--O 1.233 0.211 0 C-N-CA 122.761 0.424 . . . . 0.0 110.066 179.847 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 11.1 p -62.14 -15.4 14.1 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.588 0 C-N-CA 124.621 1.168 . . . . 0.0 113.288 -179.678 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 6' ' ' ARG . . . . . . . . . . . . . 46.9 mtm180 -114.52 129.49 56.67 Favored 'General case' 0 CA--C 1.519 -0.214 0 O-C-N 120.734 -1.229 . . . . 0.0 108.131 179.171 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 20.7 pttp -137.16 -45.76 0.57 Allowed 'General case' 0 CA--C 1.519 -0.237 0 CA-C-O 118.489 -0.767 . . . . 0.0 111.617 178.07 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 9.3 mtmp? -72.47 92.32 1.46 Allowed 'General case' 0 C--O 1.232 0.175 0 CA-C-N 119.292 0.951 . . . . 0.0 109.862 179.831 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 44.3 m -140.17 97.64 3.28 Favored 'General case' 0 C--N 1.331 -0.238 0 C-N-CA 125.205 1.402 . . . . 0.0 107.341 179.254 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 10' ' ' GLU . . . . . . . . . . . . . 28.1 tt0 -135.49 124.02 23.55 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 105.465 -2.05 . . . . 0.0 105.465 179.286 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 11' ' ' VAL . . . . . . . . . . . . . 88.7 t -114.52 -29.28 2.23 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.481 0 C-N-CA 124.542 1.137 . . . . 0.0 109.665 -179.588 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -146.13 135.08 22.55 Favored 'General case' 0 C--O 1.238 0.486 0 N-CA-C 105.006 -2.22 . . . . 0.0 105.006 178.803 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 13' ' ' GLN . . . . . . . . . . . . . 68.7 mt-30 -76.74 83.49 3.36 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 122.62 1.2 . . . . 0.0 108.735 -179.251 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 46.4 pttt -70.43 -21.16 62.85 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 115.399 -0.818 . . . . 0.0 111.772 179.388 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 4.6 t -78.12 173.15 12.54 Favored 'General case' 0 N--CA 1.449 -0.505 0 N-CA-C 108.202 -1.036 . . . . 0.0 108.202 178.472 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 24.7 t -116.28 148.18 19.17 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.504 0 N-CA-C 106.524 -1.658 . . . . 0.0 106.524 179.146 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 10.7 p -141.25 106.26 1.7 Allowed 'Isoleucine or valine' 0 N--CA 1.447 -0.614 0 N-CA-C 107.299 -1.371 . . . . 0.0 107.299 177.644 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 33.0 ttm180 -136.51 159.74 40.88 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.32 -0.855 . . . . 0.0 109.228 179.911 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 11.6 m -97.38 87.62 4.19 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 107.42 -1.326 . . . . 0.0 107.42 -179.78 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -81.82 105.49 12.99 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 108.812 -0.81 . . . . 0.0 108.812 -179.806 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 10.1 mtm180 -93.7 142.28 27.54 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 126.56 1.944 . . . . 0.0 110.918 -179.885 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 22' ' ' PHE . . . . . . . . . . . . . 78.0 m-85 -129.56 170.52 13.65 Favored 'General case' 0 N--CA 1.482 1.128 0 C-N-CA 125.192 1.397 . . . . 0.0 111.365 -179.15 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 2.0 m -99.09 166.03 13.78 Favored Pre-proline 0 CA--C 1.538 0.483 0 N-CA-C 108.04 -1.096 . . . . 0.0 108.04 178.809 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 24' ' ' PRO . . . . . . . . . . . . . 70.6 Cg_endo -69.16 -28.43 28.15 Favored 'Trans proline' 0 N--CA 1.458 -0.561 0 C-N-CA 121.442 1.428 . . . . 0.0 112.398 -179.72 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 25' ' ' VAL . . . . . . . . . . . . . 96.1 t -67.51 -56.75 12.12 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.31 0 N-CA-C 106.751 -1.574 . . . . 0.0 106.751 179.249 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 1.4 mp0 -56.44 -44.05 80.09 Favored 'General case' 0 CA--C 1.528 0.114 0 C-N-CA 124.92 1.288 . . . . 0.0 111.432 179.53 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 27' ' ' ASP . . . . . 0.424 ' HB2' HG21 ' A' ' 16' ' ' VAL . 30.1 t70 -62.78 -37.53 87.05 Favored 'General case' 0 CA--C 1.517 -0.3 0 N-CA-C 113.131 0.789 . . . . 0.0 113.131 -179.628 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 28' ' ' GLU . . . . . . . . . . . . . 32.3 tt0 -61.62 -50.82 71.0 Favored 'General case' 0 N--CA 1.45 -0.439 0 N-CA-C 107.141 -1.429 . . . . 0.0 107.141 178.963 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 30.3 m -58.83 -59.22 5.78 Favored 'General case' 0 N--CA 1.451 -0.395 0 C-N-CA 124.489 1.116 . . . . 0.0 111.279 -179.473 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 74.9 mt -56.67 -46.12 82.83 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.22 0 C-N-CA 124.45 1.1 . . . . 0.0 110.24 -178.78 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 56.4 ttt180 -62.22 -45.45 93.3 Favored 'General case' 0 CA--C 1.518 -0.279 0 CA-C-N 119.288 0.949 . . . . 0.0 111.255 -179.499 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 4.9 mptp? -60.05 -51.37 69.91 Favored 'General case' 0 CA--C 1.515 -0.397 0 N-CA-C 109.802 -0.444 . . . . 0.0 109.802 -179.059 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 37.2 mmtt -60.27 -52.99 62.92 Favored 'General case' 0 N--CA 1.449 -0.512 0 O-C-N 124.431 1.082 . . . . 0.0 111.022 -179.035 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 34' ' ' ALA . . . . . . . . . . . . . . . -55.94 -54.05 49.42 Favored 'General case' 0 N--CA 1.45 -0.467 0 C-N-CA 123.674 0.79 . . . . 0.0 111.318 -178.818 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 24.6 tt0 -63.16 -42.77 99.47 Favored 'General case' 0 N--CA 1.451 -0.406 0 N-CA-C 112.588 0.588 . . . . 0.0 112.588 -178.094 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 36' ' ' ASP . . . . . . . . . . . . . 26.9 t70 -65.64 -36.9 85.02 Favored 'General case' 0 C--O 1.232 0.143 0 C-N-CA 123.586 0.754 . . . . 0.0 110.502 -179.888 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 37' ' ' SER . . . . . . . . . . . . . 12.4 t -78.83 -7.25 57.7 Favored 'General case' 0 N--CA 1.446 -0.629 0 C-N-CA 123.995 0.918 . . . . 0.0 110.819 179.261 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 70.62 10.34 66.92 Favored Glycine 0 CA--C 1.536 1.346 0 CA-C-N 119.732 1.151 . . . . 0.0 113.28 -179.616 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 39' ' ' LEU . . . . . . . . . . . . . 15.2 mt -108.92 107.56 17.99 Favored 'General case' 0 N--CA 1.451 -0.382 0 N-CA-C 103.961 -2.607 . . . . 0.0 103.961 179.475 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 40' ' ' THR . . . . . . . . . . . . . 13.5 t -46.74 151.66 0.57 Allowed 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 123.808 0.843 . . . . 0.0 109.969 179.582 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 41' ' ' VAL . . . . . . . . . . . . . 58.8 t -43.62 -43.14 1.64 Allowed 'Isoleucine or valine' 0 CA--C 1.527 0.07 0 C-N-CA 125.441 1.496 . . . . 0.0 111.902 -178.109 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 42' ' ' SER . . . . . . . . . . . . . 5.4 p -66.55 -43.64 84.52 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-N 119.588 1.085 . . . . 0.0 112.747 179.458 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.72 -40.76 97.55 Favored 'General case' 0 C--O 1.232 0.137 0 N-CA-C 109.175 -0.676 . . . . 0.0 109.175 178.583 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 44' ' ' TYR . . . . . . . . . . . . . 64.3 t80 -60.6 -53.31 59.04 Favored 'General case' 0 N--CA 1.442 -0.841 0 N-CA-C 107.975 -1.12 . . . . 0.0 107.975 179.146 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 45' ' ' ILE . . . . . . . . . . . . . 19.7 mm -55.04 -54.46 23.85 Favored 'Isoleucine or valine' 0 C--N 1.341 0.231 0 C-N-CA 123.387 0.675 . . . . 0.0 109.285 179.521 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 46' ' ' ARG . . . . . . . . . . . . . 1.1 mtp180 -47.29 -64.59 0.74 Allowed 'General case' 0 C--O 1.22 -0.465 0 C-N-CA 124.138 0.975 . . . . 0.0 109.902 179.43 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 47' ' ' ASN . . . . . . . . . . . . . 27.4 t30 -54.19 -51.15 65.3 Favored 'General case' 0 C--N 1.325 -0.499 0 C-N-CA 126.583 1.953 . . . . 0.0 113.763 -177.944 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -60.39 -29.28 68.84 Favored 'General case' 0 N--CA 1.453 -0.324 0 C-N-CA 122.997 0.519 . . . . 0.0 112.362 -179.062 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 49' ' ' ALA . . . . . . . . . . . . . . . -86.41 -12.42 49.21 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 113.675 0.991 . . . . 0.0 113.675 -179.306 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 11.2 mt -104.86 -29.09 10.73 Favored 'General case' 0 CA--C 1.516 -0.353 0 O-C-N 121.213 -0.929 . . . . 0.0 111.154 -178.932 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 51' ' ' ASN . . . . . . . . . . . . . 74.4 m-80 . . . . . 0 C--O 1.249 1.04 0 C-N-CA 125.337 1.455 . . . . 0.0 111.298 -179.057 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 8.7 t . . . . . 0 N--CA 1.482 1.142 0 CA-C-O 122.978 1.371 . . . . 0.0 108.273 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -72.92 -43.69 62.1 Favored 'General case' 0 C--N 1.32 -0.717 1 C-N-CA 134.35 5.06 . . . . 0.0 110.324 -177.142 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 59.0 m -105.98 124.31 49.37 Favored 'General case' 0 N--CA 1.447 -0.586 0 C-N-CA 125.171 1.388 . . . . 0.0 107.291 179.178 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -151.37 156.27 40.38 Favored 'General case' 0 C--O 1.242 0.663 0 C-N-CA 125.061 1.345 . . . . 0.0 108.084 179.728 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 27.0 m -60.67 152.69 5.37 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.276 0 C-N-CA 124.2 1.0 . . . . 0.0 109.357 179.438 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 18.7 ptp180 -160.26 152.73 20.85 Favored 'General case' 0 CA--C 1.521 -0.158 0 O-C-N 121.512 -0.742 . . . . 0.0 109.744 -179.544 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 41.1 mttm -71.24 152.54 43.21 Favored 'General case' 0 C--O 1.235 0.332 0 N-CA-C 106.228 -1.767 . . . . 0.0 106.228 178.144 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -133.72 -77.52 0.47 Allowed 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 105.814 -1.921 . . . . 0.0 105.814 179.122 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 71.5 m -142.95 -167.7 2.6 Favored 'General case' 0 C--N 1.326 -0.417 0 C-N-CA 126.366 1.867 . . . . 0.0 106.347 178.893 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -153.61 -159.74 1.02 Allowed 'General case' 0 C--O 1.241 0.608 0 O-C-N 121.002 -1.061 . . . . 0.0 108.867 -179.864 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 1.4 m -55.69 113.63 0.53 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.249 0 C-N-CA 124.783 1.233 . . . . 0.0 108.701 178.994 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 6.2 ptp85 -65.32 -27.26 68.48 Favored 'General case' 0 N--CA 1.469 0.519 0 O-C-N 121.398 -0.814 . . . . 0.0 110.115 179.033 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 52.2 tt0 -124.61 99.09 6.01 Favored 'General case' 0 N--CA 1.443 -0.776 0 C-N-CA 128.565 2.746 . . . . 0.0 104.629 -179.812 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . 0.465 ' HE3' ' HG3' ' B' ' 24' ' ' PRO . 21.1 ptmt -72.25 -36.84 69.17 Favored 'General case' 0 N--CA 1.464 0.227 0 C-N-CA 124.64 1.176 . . . . 0.0 109.872 179.576 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 3.1 t -72.21 162.56 29.3 Favored 'General case' 0 N--CA 1.451 -0.391 0 N-CA-C 107.691 -1.226 . . . . 0.0 107.691 178.507 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 2.5 t -107.29 145.87 14.18 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.764 0 N-CA-C 106.552 -1.648 . . . . 0.0 106.552 179.142 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 14.5 p -140.69 110.26 3.24 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.765 0 N-CA-C 105.209 -2.145 . . . . 0.0 105.209 178.298 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 21.6 ttt85 -144.72 -175.86 4.83 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 109.348 -0.612 . . . . 0.0 109.348 -178.945 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 13.4 m -119.35 112.43 19.42 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-N 118.82 0.737 . . . . 0.0 110.519 -179.107 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.451 HD21 ' HA ' ' B' ' 42' ' ' SER . 0.0 OUTLIER -105.56 100.74 10.3 Favored 'General case' 0 C--O 1.236 0.344 0 C-N-CA 125.788 1.635 . . . . 0.0 107.64 179.788 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 6.1 mtt180 -84.97 157.46 20.79 Favored 'General case' 0 C--O 1.234 0.239 0 N-CA-C 108.437 -0.949 . . . . 0.0 108.437 177.937 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 92.7 m-85 -140.24 152.54 46.03 Favored 'General case' 0 C--O 1.236 0.359 0 N-CA-C 107.38 -1.341 . . . . 0.0 107.38 179.629 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 1.5 m -83.06 171.59 11.34 Favored Pre-proline 0 CA--C 1.547 0.832 0 CA-C-O 117.772 -1.109 . . . . 0.0 108.233 179.602 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_endo -63.75 -48.44 5.48 Favored 'Trans proline' 0 C--N 1.347 0.497 0 C-N-CA 122.025 1.817 . . . . 0.0 114.713 -177.417 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 93.9 t -64.63 -37.96 81.42 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.337 0 C-N-CA 124.787 1.235 . . . . 0.0 110.375 -179.603 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -64.33 -53.48 48.14 Favored 'General case' 0 N--CA 1.454 -0.264 0 C-N-CA 125.526 1.53 . . . . 0.0 108.043 -179.576 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 3.5 t70 -60.24 -42.91 96.27 Favored 'General case' 0 C--N 1.331 -0.204 0 C-N-CA 127.479 2.312 . . . . 0.0 111.425 179.583 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 88.7 tt0 -63.88 -49.39 72.89 Favored 'General case' 0 N--CA 1.45 -0.434 0 N-CA-C 108.018 -1.105 . . . . 0.0 108.018 179.135 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 91.2 m -58.54 -49.78 76.17 Favored 'General case' 0 CA--C 1.533 0.325 0 N-CA-C 109.169 -0.678 . . . . 0.0 109.169 179.274 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 0.403 HD13 HD11 ' A' ' 45' ' ' ILE . 34.0 mt -58.07 -46.34 88.15 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.303 0 C-N-CA 123.307 0.643 . . . . 0.0 109.38 179.54 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 29.1 ttt180 -60.36 -51.19 70.55 Favored 'General case' 0 CA--C 1.518 -0.284 0 CA-C-N 118.784 0.72 . . . . 0.0 110.839 -179.626 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 1.7 mptm? -61.85 -44.9 95.9 Favored 'General case' 0 CA--C 1.52 -0.21 0 CA-C-O 118.547 -0.74 . . . . 0.0 109.691 -179.092 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 38.4 tptt -64.57 -38.97 92.83 Favored 'General case' 0 C--O 1.224 -0.255 0 CA-C-N 118.905 0.775 . . . . 0.0 110.694 -179.614 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -63.46 -54.67 32.82 Favored 'General case' 0 C--O 1.234 0.263 0 C-N-CA 125.258 1.423 . . . . 0.0 108.578 178.839 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 7.4 tp10 -59.16 -40.05 84.4 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 124.324 1.049 . . . . 0.0 110.48 -179.364 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -71.38 -37.24 71.59 Favored 'General case' 0 CA--C 1.53 0.199 0 C-N-CA 125.751 1.62 . . . . 0.0 111.713 179.704 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 22.7 t -76.67 -15.63 59.75 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 124.441 1.096 . . . . 0.0 111.393 179.784 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 77.54 34.43 39.91 Favored Glycine 0 CA--C 1.53 0.97 0 N-CA-C 110.017 -1.233 . . . . 0.0 110.017 -179.121 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 90.8 mt -136.49 132.69 35.66 Favored 'General case' 0 CA--C 1.514 -0.424 0 N-CA-C 106.735 -1.58 . . . . 0.0 106.735 179.792 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 6.7 t -62.68 150.91 39.77 Favored 'General case' 0 CA--C 1.537 0.471 0 N-CA-C 107.544 -1.28 . . . . 0.0 107.544 178.616 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 41.7 t -47.09 -45.13 8.3 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.446 0 C-N-CA 125.025 1.33 . . . . 0.0 111.513 -179.752 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 56.7 p -56.73 -45.5 81.9 Favored 'General case' 0 CA--C 1.535 0.39 0 CA-C-N 119.029 0.831 . . . . 0.0 111.922 -179.625 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -71.72 -44.33 64.34 Favored 'General case' 0 N--CA 1.449 -0.48 0 C-N-CA 124.369 1.068 . . . . 0.0 109.5 179.104 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 93.2 t80 -52.1 -48.75 64.6 Favored 'General case' 0 CA--C 1.53 0.182 0 C-N-CA 124.519 1.128 . . . . 0.0 109.196 179.79 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.508 HG23 HG23 ' B' ' 45' ' ' ILE . 24.2 mm -55.74 -66.61 0.27 Allowed 'Isoleucine or valine' 0 C--O 1.226 -0.143 0 C-N-CA 123.918 0.887 . . . . 0.0 111.411 179.626 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 15.7 ptt180 -58.54 -45.39 89.0 Favored 'General case' 0 C--O 1.219 -0.516 0 CA-C-O 118.398 -0.81 . . . . 0.0 112.001 -177.811 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 16.6 t30 -55.34 -47.72 75.27 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 119.153 0.888 . . . . 0.0 111.451 -179.41 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -67.51 -30.9 70.69 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 122.823 0.449 . . . . 0.0 111.896 179.452 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -77.58 -29.01 51.87 Favored 'General case' 0 N--CA 1.451 -0.418 0 C-N-CA 124.245 1.018 . . . . 0.0 113.432 -179.65 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 8.9 mt -89.23 -39.52 13.47 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 113.279 0.844 . . . . 0.0 113.279 -178.33 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 65.7 m-20 . . . . . 0 C--O 1.251 1.181 0 C-N-CA 123.566 0.746 . . . . 0.0 112.657 -178.446 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 1' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.484 1.242 0 CA-C-O 124.525 2.107 . . . . 0.0 105.579 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 2' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -86.89 -56.19 3.5 Favored 'General case' 0 C--N 1.317 -0.812 1 C-N-CA 136.133 5.773 . . . . 0.0 107.858 -176.166 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 3' ' ' SER . . . . . . . . . . . . . 58.8 m -101.22 125.99 47.9 Favored 'General case' 0 N--CA 1.45 -0.462 0 N-CA-C 107.316 -1.365 . . . . 0.0 107.316 178.987 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 4' ' ' ALA . . . . . . . . . . . . . . . -143.92 143.59 31.33 Favored 'General case' 0 C--O 1.24 0.569 0 N-CA-C 107.592 -1.262 . . . . 0.0 107.592 179.292 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 12.4 p -54.96 144.49 6.04 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.313 0 C-N-CA 124.855 1.262 . . . . 0.0 110.014 -179.761 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 6' ' ' ARG . . . . . . . . . . . . . 17.2 ptp180 -159.47 158.54 32.17 Favored 'General case' 0 C--N 1.333 -0.115 0 C-N-CA 125.005 1.322 . . . . 0.0 107.537 -179.802 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 10.1 pttp -63.04 150.56 42.22 Favored 'General case' 0 C--O 1.233 0.213 0 O-C-N 123.353 0.408 . . . . 0.0 111.785 -179.324 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 1.4 tmtp? -140.0 -64.55 0.48 Allowed 'General case' 0 C--O 1.233 0.227 0 N-CA-C 107.87 -1.159 . . . . 0.0 107.87 178.898 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 5.4 m -135.25 175.22 9.78 Favored 'General case' 0 C--N 1.332 -0.172 0 C-N-CA 125.063 1.345 . . . . 0.0 110.234 179.9 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 10' ' ' GLU . . . . . . . . . . . . . 23.2 tt0 -148.31 179.66 7.61 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 124.93 1.292 . . . . 0.0 108.293 -179.842 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 11' ' ' VAL . . . . . . . . . . . . . 12.7 m -61.65 111.16 0.7 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.347 0 N-CA-C 108.056 -1.09 . . . . 0.0 108.056 179.273 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 12' ' ' ARG . . . . . . . . . . . . . 10.1 ptp85 -59.24 -32.26 69.81 Favored 'General case' 0 N--CA 1.464 0.262 0 N-CA-C 113.473 0.916 . . . . 0.0 113.473 -178.252 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 13' ' ' GLN . . . . . . . . . . . . . 9.7 tt0 -120.67 94.71 4.45 Favored 'General case' 0 N--CA 1.452 -0.333 0 N-CA-C 105.775 -1.935 . . . . 0.0 105.775 -179.58 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 19.5 ptmt -62.88 -32.7 74.01 Favored 'General case' 0 N--CA 1.455 -0.215 0 C-N-CA 124.137 0.975 . . . . 0.0 109.74 179.295 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 4.3 t -81.88 163.07 22.52 Favored 'General case' 0 N--CA 1.449 -0.5 0 N-CA-C 108.059 -1.089 . . . . 0.0 108.059 178.594 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 5.8 t -107.18 157.07 7.45 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 N-CA-C 106.34 -1.726 . . . . 0.0 106.34 178.405 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 10.9 p -151.21 120.4 0.87 Allowed 'Isoleucine or valine' 0 N--CA 1.444 -0.76 0 N-CA-C 105.017 -2.216 . . . . 0.0 105.017 178.585 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 4.9 ttt85 -145.96 175.67 10.27 Favored 'General case' 0 C--O 1.238 0.457 0 C-N-CA 119.646 -0.822 . . . . 0.0 111.702 -179.845 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 20.9 m -115.27 76.67 1.01 Allowed 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 106.708 -1.59 . . . . 0.0 106.708 -179.631 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 52.6 tp -89.52 93.16 9.39 Favored 'General case' 0 N--CA 1.448 -0.558 0 C-N-CA 127.362 2.265 . . . . 0.0 107.935 -179.212 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 41.2 mtt180 -76.89 164.56 25.69 Favored 'General case' 0 C--N 1.326 -0.44 0 C-N-CA 123.715 0.806 . . . . 0.0 110.963 -179.728 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 22' ' ' PHE . . . . . . . . . . . . . 69.3 m-85 -142.47 148.56 37.91 Favored 'General case' 0 C--O 1.237 0.395 0 N-CA-C 107.57 -1.27 . . . . 0.0 107.57 179.849 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 49.3 m -79.62 166.12 43.25 Favored Pre-proline 0 CA--C 1.541 0.612 0 N-CA-C 107.771 -1.196 . . . . 0.0 107.771 179.33 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 24' ' ' PRO . . . . . 0.465 ' HG3' ' HE3' ' A' ' 14' ' ' LYS . 55.2 Cg_endo -64.73 -35.43 46.21 Favored 'Trans proline' 0 C--N 1.348 0.517 0 C-N-CA 121.517 1.478 . . . . 0.0 112.118 -178.696 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 25' ' ' VAL . . . . . . . . . . . . . 89.4 t -60.62 -55.25 25.71 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.375 0 N-CA-C 108.219 -1.03 . . . . 0.0 108.219 179.392 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 4.2 mm-40 -59.92 -44.48 94.3 Favored 'General case' 0 CA--C 1.53 0.206 0 C-N-CA 125.338 1.455 . . . . 0.0 111.109 -178.977 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 27' ' ' ASP . . . . . . . . . . . . . 13.5 t70 -60.97 -46.08 92.17 Favored 'General case' 0 CA--C 1.514 -0.407 0 C-N-CA 125.64 1.576 . . . . 0.0 111.234 179.828 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 28' ' ' GLU . . . . . . . . . . . . . 87.6 tt0 -60.51 -48.18 82.9 Favored 'General case' 0 N--CA 1.448 -0.534 0 N-CA-C 108.387 -0.968 . . . . 0.0 108.387 179.098 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 39.2 m -57.02 -58.08 9.74 Favored 'General case' 0 CA--C 1.536 0.414 0 N-CA-C 109.449 -0.575 . . . . 0.0 109.449 179.522 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 63.4 mt -57.67 -44.02 84.75 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.314 0 C-N-CA 124.456 1.103 . . . . 0.0 111.093 -178.761 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 20.4 ttt180 -61.94 -49.55 75.69 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 119.133 0.879 . . . . 0.0 110.508 179.889 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 1.2 mptm? -62.75 -44.24 96.72 Favored 'General case' 0 CA--C 1.518 -0.252 0 O-C-N 123.463 0.477 . . . . 0.0 110.033 -178.102 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 36.3 tptt -67.94 -43.41 79.16 Favored 'General case' 0 C--O 1.221 -0.436 0 CA-C-O 118.714 -0.66 . . . . 0.0 111.155 -179.584 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 34' ' ' ALA . . . . . . . . . . . . . . . -57.64 -52.29 66.04 Favored 'General case' 0 C--N 1.329 -0.286 0 C-N-CA 124.029 0.932 . . . . 0.0 110.646 179.819 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 31.1 tp10 -63.36 -37.51 87.55 Favored 'General case' 0 CA--C 1.534 0.331 0 N-CA-C 110.46 -0.2 . . . . 0.0 110.46 -178.841 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 36' ' ' ASP . . . . . . . . . . . . . 34.8 t70 -69.28 -41.34 76.98 Favored 'General case' 0 C--O 1.232 0.156 0 C-N-CA 124.419 1.088 . . . . 0.0 111.038 179.741 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 37' ' ' SER . . . . . . . . . . . . . 1.4 t -70.16 -27.17 64.32 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 124.253 1.021 . . . . 0.0 108.886 179.23 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 85.71 22.4 50.26 Favored Glycine 0 CA--C 1.53 1.007 0 N-CA-C 109.959 -1.257 . . . . 0.0 109.959 -178.933 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 39' ' ' LEU . . . . . . . . . . . . . 86.9 mt -122.99 115.0 21.17 Favored 'General case' 0 CA--C 1.508 -0.661 0 N-CA-C 104.034 -2.58 . . . . 0.0 104.034 -179.823 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 40' ' ' THR . . . . . . . . . . . . . 9.0 t -51.9 158.57 1.01 Allowed 'General case' 0 CA--C 1.534 0.345 0 N-CA-C 109.741 -0.466 . . . . 0.0 109.741 179.299 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 41' ' ' VAL . . . . . . . . . . . . . 94.4 t -46.64 -42.11 5.38 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.294 0 C-N-CA 124.201 1.0 . . . . 0.0 112.086 -178.899 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 42' ' ' SER . . . . . 0.451 ' HA ' HD21 ' A' ' 20' ' ' LEU . 19.4 p -64.33 -46.79 81.96 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-N 120.516 1.507 . . . . 0.0 112.109 179.704 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.61 -46.46 85.64 Favored 'General case' 0 C--O 1.222 -0.389 0 C-N-CA 124.23 1.012 . . . . 0.0 108.721 179.119 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 44' ' ' TYR . . . . . . . . . . . . . 82.7 t80 -55.07 -52.98 61.52 Favored 'General case' 0 N--CA 1.447 -0.576 0 C-N-CA 124.399 1.08 . . . . 0.0 109.081 179.426 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 45' ' ' ILE . . . . . 0.508 HG23 HG23 ' A' ' 45' ' ' ILE . 11.0 mm -55.89 -62.25 0.89 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.25 0 C-N-CA 124.688 1.195 . . . . 0.0 111.504 179.781 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 46' ' ' ARG . . . . . . . . . . . . . 22.4 ptt180 -58.67 -39.27 80.15 Favored 'General case' 0 N--CA 1.454 -0.262 0 CA-C-O 117.809 -1.091 . . . . 0.0 112.847 -177.69 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 47' ' ' ASN . . . . . . . . . . . . . 29.2 t30 -65.12 -56.01 15.44 Favored 'General case' 0 C--N 1.332 -0.162 0 C-N-CA 124.255 1.022 . . . . 0.0 109.409 179.212 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -56.9 -29.27 62.86 Favored 'General case' 0 N--CA 1.454 -0.274 0 C-N-CA 124.453 1.101 . . . . 0.0 112.055 -179.385 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 49' ' ' ALA . . . . . . . . . . . . . . . -75.08 -25.6 58.69 Favored 'General case' 0 N--CA 1.445 -0.714 0 N-CA-C 113.748 1.018 . . . . 0.0 113.748 179.982 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 10.7 mt -93.72 -44.79 7.98 Favored 'General case' 0 C--O 1.238 0.461 0 C-N-CA 123.373 0.669 . . . . 0.0 109.226 -179.847 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 51' ' ' ASN . . . . . . . . . . . . . 73.0 m-20 . . . . . 0 C--O 1.251 1.132 0 C-N-CA 125.558 1.543 . . . . 0.0 109.99 -179.751 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 10.8 m . . . . . 0 CA--C 1.511 -0.534 0 N-CA-C 107.624 -1.25 . . . . 0.0 107.624 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -77.31 81.32 3.8 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 105.892 -1.892 . . . . 0.0 105.892 179.828 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 60.7 m -114.32 123.33 49.25 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 124.48 1.112 . . . . 0.0 110.253 -178.664 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -144.28 141.78 30.02 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 123.551 0.74 . . . . 0.0 110.396 -179.818 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 34.5 m -140.12 155.97 24.39 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.309 0 C-N-CA 124.329 1.052 . . . . 0.0 108.953 179.392 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 27.7 mmt85 -137.43 22.52 2.95 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 125.496 1.519 . . . . 0.0 107.579 177.404 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 15.8 mmtp -65.47 164.04 14.69 Favored 'General case' 0 C--O 1.238 0.461 0 CA-C-O 121.831 0.824 . . . . 0.0 108.933 179.651 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 41.0 mtmt -135.14 161.33 35.65 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 106.159 -1.793 . . . . 0.0 106.159 179.287 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 22.5 p -139.47 -1.64 1.67 Allowed 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 112.328 0.492 . . . . 0.0 112.328 -179.615 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . 0.455 ' HB2' HH11 ' A' ' 12' ' ' ARG . 1.8 pm0 -91.98 148.21 22.37 Favored 'General case' 0 N--CA 1.45 -0.437 0 O-C-N 121.647 -0.658 . . . . 0.0 109.742 179.563 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 8.3 p -157.78 -20.96 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.538 0.513 0 C-N-CA 124.584 1.153 . . . . 0.0 111.765 -179.588 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . 0.455 HH11 ' HB2' ' A' ' 10' ' ' GLU . 0.1 OUTLIER 49.14 42.26 21.01 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 125.537 1.535 . . . . 0.0 112.176 -179.301 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 6.6 tt0 -113.27 117.49 31.99 Favored 'General case' 0 C--N 1.33 -0.251 0 C-N-CA 125.263 1.425 . . . . 0.0 107.589 179.564 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 21.1 pttm -84.56 -31.65 24.24 Favored 'General case' 0 CA--C 1.535 0.381 0 N-CA-C 109.434 -0.58 . . . . 0.0 109.434 177.97 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 2.8 t -80.19 -174.06 4.32 Favored 'General case' 0 N--CA 1.446 -0.673 0 C-N-CA 125.322 1.449 . . . . 0.0 108.253 179.546 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.407 HG21 ' HB2' ' B' ' 27' ' ' ASP . 6.2 t -132.48 148.74 31.78 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.657 0 N-CA-C 105.65 -1.982 . . . . 0.0 105.65 178.963 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 14.8 p -139.1 112.96 6.92 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.038 0 N-CA-C 105.815 -1.92 . . . . 0.0 105.815 178.02 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 17.7 ttt180 -140.93 178.81 7.1 Favored 'General case' 0 C--O 1.236 0.388 0 N-CA-C 107.549 -1.278 . . . . 0.0 107.549 -179.635 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 6.4 m -116.77 108.03 15.38 Favored 'General case' 0 C--O 1.237 0.414 0 N-CA-C 106.91 -1.515 . . . . 0.0 106.91 179.765 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.412 HD12 ' CZ ' ' A' ' 22' ' ' PHE . 0.0 OUTLIER -96.49 99.77 11.41 Favored 'General case' 0 C--O 1.235 0.308 0 N-CA-C 108.435 -0.95 . . . . 0.0 108.435 -178.94 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 1.2 mmt-85 -81.65 154.9 25.88 Favored 'General case' 0 C--O 1.235 0.316 0 C-N-CA 123.36 0.664 . . . . 0.0 109.484 179.094 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . 0.412 ' CZ ' HD12 ' A' ' 20' ' ' LEU . 96.9 m-85 -148.05 152.84 38.07 Favored 'General case' 0 CA--C 1.516 -0.344 0 C-N-CA 124.206 1.002 . . . . 0.0 108.644 178.633 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 14.5 m -79.49 167.04 37.25 Favored Pre-proline 0 CA--C 1.545 0.76 0 N-CA-C 107.496 -1.298 . . . . 0.0 107.496 178.603 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 34.5 Cg_endo -63.38 -43.01 19.41 Favored 'Trans proline' 0 N--CA 1.461 -0.418 0 C-N-CA 121.515 1.477 . . . . 0.0 112.025 -178.713 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 60.7 t -66.49 -39.36 83.81 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.557 0 C-N-CA 124.198 0.999 . . . . 0.0 109.921 179.795 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 97.5 mt-10 -63.7 -41.45 98.12 Favored 'General case' 0 N--CA 1.465 0.279 0 O-C-N 121.209 -0.932 . . . . 0.0 109.731 179.707 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . 0.502 ' HB2' HG21 ' B' ' 16' ' ' VAL . 27.1 t70 -68.19 -47.51 67.74 Favored 'General case' 0 C--O 1.218 -0.595 0 C-N-CA 124.445 1.098 . . . . 0.0 110.719 179.442 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -58.01 -34.26 69.83 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 118.692 0.678 . . . . 0.0 109.268 178.794 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 39.5 m -70.88 -60.71 2.09 Favored 'General case' 0 N--CA 1.45 -0.433 0 O-C-N 121.795 -0.566 . . . . 0.0 109.614 179.309 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 51.0 mt -58.73 -42.6 85.74 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.295 0 C-N-CA 123.765 0.826 . . . . 0.0 111.814 -178.247 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 59.7 ttt180 -64.27 -44.83 90.5 Favored 'General case' 0 N--CA 1.448 -0.538 0 CA-C-O 117.336 -1.316 . . . . 0.0 110.539 -179.481 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 2.1 mptp? -68.03 -44.73 75.8 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-N 119.863 1.211 . . . . 0.0 109.282 179.536 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 37.0 mmtt -55.93 -49.17 74.24 Favored 'General case' 0 CA--C 1.518 -0.253 0 C-N-CA 123.686 0.795 . . . . 0.0 110.609 -179.779 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -59.41 -53.8 54.05 Favored 'General case' 0 N--CA 1.444 -0.76 0 C-N-CA 125.419 1.487 . . . . 0.0 110.264 179.897 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 25.7 tt0 -57.76 -41.26 81.58 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 123.761 0.824 . . . . 0.0 110.805 -179.498 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 29.2 t70 -68.34 -40.24 81.61 Favored 'General case' 0 N--CA 1.463 0.201 0 C-N-CA 125.452 1.501 . . . . 0.0 109.95 179.663 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 22.5 t -73.06 -15.39 61.51 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 123.817 0.847 . . . . 0.0 109.647 178.356 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 75.21 0.82 62.34 Favored Glycine 0 CA--C 1.533 1.207 0 O-C-N 120.817 -1.177 . . . . 0.0 110.161 -178.189 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 40.7 mt -96.53 114.41 26.07 Favored 'General case' 0 N--CA 1.449 -0.49 0 N-CA-C 104.713 -2.329 . . . . 0.0 104.713 179.543 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 4.3 t -51.66 153.78 2.23 Favored 'General case' 0 CA--C 1.539 0.531 0 N-CA-C 109.475 -0.565 . . . . 0.0 109.475 179.336 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 55.8 t -44.88 -42.79 2.48 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.124 0 C-N-CA 124.964 1.306 . . . . 0.0 112.205 -178.805 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 1.6 p -63.22 -45.54 91.17 Favored 'General case' 0 CA--C 1.536 0.416 0 CA-C-N 119.034 0.834 . . . . 0.0 112.032 179.859 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -65.97 -45.37 81.93 Favored 'General case' 0 C--O 1.222 -0.38 0 C-N-CA 123.7 0.8 . . . . 0.0 109.083 178.777 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 65.1 t80 -56.07 -52.04 65.69 Favored 'General case' 0 N--CA 1.452 -0.361 0 C-N-CA 124.702 1.201 . . . . 0.0 109.11 179.888 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 3.9 mm -54.79 -62.66 0.7 Allowed 'Isoleucine or valine' 0 N--CA 1.457 -0.087 0 C-N-CA 124.91 1.284 . . . . 0.0 110.588 179.782 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 14.5 ptt180 -58.36 -46.66 85.87 Favored 'General case' 0 C--O 1.222 -0.369 0 CA-C-O 118.311 -0.852 . . . . 0.0 111.368 -178.195 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 22.0 t30 -56.66 -54.57 44.52 Favored 'General case' 0 C--O 1.225 -0.205 0 CA-C-N 119.181 0.901 . . . . 0.0 110.251 -179.748 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -60.25 -33.78 72.78 Favored 'General case' 0 N--CA 1.452 -0.337 0 N-CA-C 112.409 0.522 . . . . 0.0 112.409 -179.45 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -72.24 -40.89 67.39 Favored 'General case' 0 C--O 1.232 0.182 0 N-CA-C 113.049 0.759 . . . . 0.0 113.049 -179.154 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 14.7 mt -85.04 -37.03 20.83 Favored 'General case' 0 C--N 1.331 -0.232 0 C-N-CA 124.334 1.054 . . . . 0.0 113.295 -177.938 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 72.6 m-80 . . . . . 0 C--O 1.259 1.595 0 N-CA-C 113.684 0.994 . . . . 0.0 113.684 -177.095 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 1' ' ' SER . . . . . . . . . . . . . 6.3 m . . . . . 0 CA--C 1.511 -0.542 0 N-CA-C 107.483 -1.303 . . . . 0.0 107.483 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 2' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -84.23 49.6 1.69 Allowed 'General case' 0 C--N 1.324 -0.526 0 C-N-CA 126.477 1.911 . . . . 0.0 108.279 -179.073 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 3' ' ' SER . . . . . . . . . . . . . 13.8 m -69.04 134.76 49.86 Favored 'General case' 0 N--CA 1.443 -0.808 0 C-N-CA 127.681 2.393 . . . . 0.0 109.196 -179.426 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 4' ' ' ALA . . . . . . . . . . . . . . . -140.79 114.51 8.91 Favored 'General case' 0 N--CA 1.452 -0.358 0 N-CA-C 108.6 -0.889 . . . . 0.0 108.6 -179.884 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 20.9 m -129.08 141.58 46.25 Favored 'Isoleucine or valine' 0 C--O 1.234 0.243 0 C-N-CA 124.935 1.294 . . . . 0.0 107.878 179.372 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 6' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -134.21 41.36 2.97 Favored 'General case' 0 C--O 1.236 0.392 0 C-N-CA 125.58 1.552 . . . . 0.0 110.972 -179.798 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 6.0 mptp? -77.96 -177.49 5.01 Favored 'General case' 0 C--N 1.327 -0.393 0 C-N-CA 125.468 1.507 . . . . 0.0 108.409 178.87 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 2.1 mtmm -149.17 166.28 29.3 Favored 'General case' 0 C--O 1.239 0.527 0 C-N-CA 127.797 2.439 . . . . 0.0 105.843 178.328 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 14.1 p -143.34 -13.39 0.7 Allowed 'General case' 0 C--N 1.33 -0.254 0 N-CA-C 114.825 1.417 . . . . 0.0 114.825 -178.95 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 10' ' ' GLU . . . . . . . . . . . . . 1.2 pm0 -81.63 94.95 7.04 Favored 'General case' 0 N--CA 1.456 -0.155 0 C-N-CA 125.798 1.639 . . . . 0.0 110.985 -179.3 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 11' ' ' VAL . . . . . . . . . . . . . 19.6 m -93.72 -11.89 8.94 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.439 0 O-C-N 121.327 -0.858 . . . . 0.0 112.662 179.769 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 12' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER 43.89 58.33 3.67 Favored 'General case' 0 N--CA 1.469 0.496 0 C-N-CA 125.272 1.429 . . . . 0.0 111.627 -179.63 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 13' ' ' GLN . . . . . . . . . . . . . 12.9 tt0 -140.43 115.75 9.95 Favored 'General case' 0 C--O 1.235 0.327 0 C-N-CA 125.114 1.366 . . . . 0.0 109.258 -179.234 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 23.5 pttm -80.15 -42.47 23.38 Favored 'General case' 0 N--CA 1.462 0.147 0 N-CA-C 109.254 -0.647 . . . . 0.0 109.254 178.748 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 10.5 t -69.13 178.51 2.26 Favored 'General case' 0 N--CA 1.449 -0.486 0 C-N-CA 124.597 1.159 . . . . 0.0 108.302 179.169 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 16' ' ' VAL . . . . . 0.502 HG21 ' HB2' ' A' ' 27' ' ' ASP . 5.6 t -125.43 145.62 32.49 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.588 0 N-CA-C 106.518 -1.66 . . . . 0.0 106.518 179.575 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 9.4 p -137.82 119.1 17.43 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.365 0 N-CA-C 108.46 -0.941 . . . . 0.0 108.46 -179.932 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 17.8 ttt180 -149.43 157.9 43.7 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-O 120.519 0.2 . . . . 0.0 110.814 179.073 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 1.6 m -94.96 93.84 7.65 Favored 'General case' 0 N--CA 1.451 -0.413 0 C-N-CA 125.28 1.432 . . . . 0.0 107.917 179.934 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -95.49 94.8 8.0 Favored 'General case' 0 C--N 1.327 -0.409 0 C-N-CA 124.574 1.15 . . . . 0.0 108.869 -179.654 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 20.5 mmm-85 -76.47 147.68 37.71 Favored 'General case' 0 C--O 1.239 0.514 0 N-CA-C 108.799 -0.815 . . . . 0.0 108.799 179.273 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 22' ' ' PHE . . . . . . . . . . . . . 92.3 m-85 -136.0 153.46 51.37 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 124.674 1.19 . . . . 0.0 108.796 179.541 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 18.7 m -82.04 168.7 22.09 Favored Pre-proline 0 CA--C 1.541 0.614 0 C-N-CA 124.313 1.045 . . . . 0.0 109.74 179.232 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 24' ' ' PRO . . . . . . . . . . . . . 33.0 Cg_endo -64.36 -36.58 44.27 Favored 'Trans proline' 0 C--N 1.349 0.582 0 C-N-CA 121.658 1.572 . . . . 0.0 111.205 -179.391 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 25' ' ' VAL . . . . . . . . . . . . . 86.0 t -66.34 -45.54 89.27 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.211 0 N-CA-C 108.35 -0.981 . . . . 0.0 108.35 179.02 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 96.7 mt-10 -60.9 -49.58 76.88 Favored 'General case' 0 N--CA 1.455 -0.21 0 C-N-CA 123.62 0.768 . . . . 0.0 110.856 -179.319 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 27' ' ' ASP . . . . . 0.407 ' HB2' HG21 ' A' ' 16' ' ' VAL . 33.6 t70 -60.31 -53.27 59.65 Favored 'General case' 0 CA--C 1.502 -0.871 0 CA-C-O 117.401 -1.285 . . . . 0.0 111.751 -179.365 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 28' ' ' GLU . . . . . . . . . . . . . 24.2 mm-40 -57.53 -44.37 85.06 Favored 'General case' 0 N--CA 1.454 -0.258 0 CA-C-N 118.855 0.752 . . . . 0.0 109.012 -179.442 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 30.6 m -58.15 -53.05 62.65 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-N 118.536 0.607 . . . . 0.0 110.45 179.966 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 57.7 mt -61.74 -44.48 98.83 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.269 0 C-N-CA 124.323 1.049 . . . . 0.0 110.831 -179.414 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 24.7 ttt180 -62.62 -46.34 88.7 Favored 'General case' 0 C--N 1.325 -0.486 0 C-N-CA 126.204 1.801 . . . . 0.0 111.32 -178.902 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 4.7 mptp? -66.78 -42.84 85.41 Favored 'General case' 0 CA--C 1.518 -0.253 0 N-CA-C 108.9 -0.778 . . . . 0.0 108.9 -179.561 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 39.3 mmtt -63.15 -53.34 54.91 Favored 'General case' 0 C--O 1.222 -0.389 0 C-N-CA 123.496 0.718 . . . . 0.0 109.93 179.219 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 34' ' ' ALA . . . . . . . . . . . . . . . -52.51 -50.6 62.47 Favored 'General case' 0 C--O 1.236 0.359 0 C-N-CA 124.836 1.254 . . . . 0.0 111.394 -178.826 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -63.76 -39.95 95.51 Favored 'General case' 0 CA--C 1.532 0.258 0 CA-C-O 119.195 -0.431 . . . . 0.0 111.822 -179.573 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 36' ' ' ASP . . . . . . . . . . . . . 37.6 t70 -75.08 -30.73 61.02 Favored 'General case' 0 N--CA 1.465 0.317 0 C-N-CA 123.959 0.904 . . . . 0.0 112.931 -178.285 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 37' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -86.99 -6.13 58.86 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-O 118.156 -0.926 . . . . 0.0 112.459 -179.488 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 75.89 14.35 82.26 Favored Glycine 0 CA--C 1.534 1.262 0 CA-C-N 119.87 1.214 . . . . 0.0 114.172 179.348 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 39' ' ' LEU . . . . . . . . . . . . . 20.9 mt -121.68 112.27 18.22 Favored 'General case' 0 CA--C 1.517 -0.316 0 N-CA-C 105.828 -1.916 . . . . 0.0 105.828 179.623 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 40' ' ' THR . . . . . . . . . . . . . 14.1 t -52.05 156.11 1.67 Allowed 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 124.702 1.201 . . . . 0.0 109.561 179.163 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 41' ' ' VAL . . . . . . . . . . . . . 78.2 t -44.62 -47.39 2.61 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.232 0 C-N-CA 125.216 1.406 . . . . 0.0 112.566 -177.951 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 42' ' ' SER . . . . . . . . . . . . . 14.1 m -63.15 -47.45 82.63 Favored 'General case' 0 CA--C 1.543 0.696 0 CA-C-N 118.792 0.724 . . . . 0.0 111.523 -179.432 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -65.04 -43.3 92.84 Favored 'General case' 0 C--O 1.22 -0.476 0 C-N-CA 124.475 1.11 . . . . 0.0 109.788 178.644 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 44' ' ' TYR . . . . . . . . . . . . . 80.8 t80 -53.79 -53.72 48.35 Favored 'General case' 0 N--CA 1.455 -0.183 0 C-N-CA 125.515 1.526 . . . . 0.0 108.551 179.447 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 45' ' ' ILE . . . . . . . . . . . . . 18.5 mm -54.7 -61.21 1.07 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.226 0 C-N-CA 123.948 0.899 . . . . 0.0 111.202 179.595 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 46' ' ' ARG . . . . . . . . . . . . . 29.0 ptt180 -57.7 -45.23 85.98 Favored 'General case' 0 N--CA 1.466 0.374 0 O-C-N 121.975 -0.453 . . . . 0.0 111.345 -178.324 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 47' ' ' ASN . . . . . . . . . . . . . 35.2 t30 -57.91 -55.63 32.39 Favored 'General case' 0 N--CA 1.449 -0.504 0 C-N-CA 123.697 0.799 . . . . 0.0 111.436 -179.389 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -62.29 -32.01 72.68 Favored 'General case' 0 CA--C 1.529 0.171 0 C-N-CA 124.313 1.045 . . . . 0.0 112.385 -179.656 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 49' ' ' ALA . . . . . . . . . . . . . . . -77.14 -40.91 43.88 Favored 'General case' 0 N--CA 1.451 -0.394 0 N-CA-C 113.195 0.813 . . . . 0.0 113.195 -178.75 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 22.8 mt -74.18 -43.18 58.28 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 118.467 0.576 . . . . 0.0 111.685 -178.919 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 51' ' ' ASN . . . . . . . . . . . . . 53.3 m-80 . . . . . 0 C--O 1.254 1.326 0 CA-C-O 117.951 -1.023 . . . . 0.0 110.927 -179.785 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 10.2 m . . . . . 0 CA--C 1.514 -0.435 0 N-CA-C 107.33 -1.359 . . . . 0.0 107.33 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 4.4 p-10 -144.16 -149.76 0.29 Allowed 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 126.592 1.957 . . . . 0.0 106.381 -179.412 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 23.4 m -147.48 17.03 1.16 Allowed 'General case' 0 CA--C 1.539 0.529 0 CA-C-N 120.672 1.578 . . . . 0.0 113.089 179.895 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -59.55 -18.48 41.01 Favored 'General case' 0 CA--C 1.53 0.199 0 C-N-CA 124.384 1.074 . . . . 0.0 113.655 -179.543 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 14.1 p -52.31 -26.91 9.78 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.661 0 C-N-CA 124.806 1.242 . . . . 0.0 111.849 179.341 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 31.2 ptt85 -69.28 -0.84 6.76 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 124.552 1.141 . . . . 0.0 113.796 179.309 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 15.9 pttp -143.01 120.88 11.96 Favored 'General case' 0 C--O 1.227 -0.081 0 CA-C-N 119.909 1.232 . . . . 0.0 110.067 -179.86 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 50.8 mtmt -92.6 1.77 57.07 Favored 'General case' 0 N--CA 1.469 0.512 0 O-C-N 121.405 -0.81 . . . . 0.0 110.671 178.586 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 16.4 p -149.7 -179.95 7.52 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 127.111 2.165 . . . . 0.0 109.26 -179.482 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 39.2 mt-10 -134.02 173.27 11.75 Favored 'General case' 0 CA--C 1.528 0.117 0 C-N-CA 124.399 1.08 . . . . 0.0 111.053 -178.961 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 3.0 m -124.31 102.02 10.11 Favored 'Isoleucine or valine' 0 C--O 1.234 0.264 0 N-CA-C 106.104 -1.813 . . . . 0.0 106.104 178.945 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 14.5 ptp180 -164.17 123.97 2.03 Favored 'General case' 0 C--O 1.236 0.36 0 C-N-CA 127.518 2.327 . . . . 0.0 105.269 179.449 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 59.5 mt-30 -105.41 87.45 2.62 Favored 'General case' 0 N--CA 1.443 -0.799 0 N-CA-C 105.396 -2.076 . . . . 0.0 105.396 -178.695 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 5.7 ptpt -58.31 -22.81 54.46 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-N 114.612 -1.177 . . . . 0.0 112.841 179.933 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 4.8 t -84.74 160.99 20.18 Favored 'General case' 0 N--CA 1.447 -0.62 0 N-CA-C 109.333 -0.618 . . . . 0.0 109.333 178.774 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 9.3 t -109.96 84.5 0.73 Allowed 'Isoleucine or valine' 0 CA--C 1.513 -0.448 0 N-CA-C 109.765 -0.457 . . . . 0.0 109.765 -179.663 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 11.8 p -83.24 121.01 35.55 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.498 0 N-CA-C 105.502 -2.036 . . . . 0.0 105.502 178.107 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 13.0 ttt85 -157.07 163.21 39.26 Favored 'General case' 0 C--O 1.236 0.39 0 N-CA-C 107.79 -1.189 . . . . 0.0 107.79 179.042 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 2.2 m -102.14 130.71 48.84 Favored 'General case' 0 C--N 1.327 -0.413 0 N-CA-C 106.716 -1.587 . . . . 0.0 106.716 179.698 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -130.43 125.87 35.55 Favored 'General case' 0 N--CA 1.448 -0.533 0 N-CA-C 107.005 -1.48 . . . . 0.0 107.005 179.171 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 15.2 mtp180 -107.21 155.55 19.79 Favored 'General case' 0 N--CA 1.455 -0.219 0 C-N-CA 124.306 1.042 . . . . 0.0 111.136 179.666 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 35.5 m-85 -133.73 -171.41 2.71 Favored 'General case' 0 C--O 1.236 0.365 0 C-N-CA 125.567 1.547 . . . . 0.0 108.512 179.787 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 1.2 m -118.18 175.75 1.95 Allowed Pre-proline 0 CA--C 1.539 0.542 0 CA-C-O 117.218 -1.373 . . . . 0.0 107.668 179.433 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_endo -65.0 -51.06 1.77 Allowed 'Trans proline' 0 N--CA 1.458 -0.574 0 CA-C-N 121.458 1.556 . . . . 0.0 111.869 -178.368 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 57.9 t -59.46 -44.3 92.48 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.268 0 C-N-CA 124.713 1.205 . . . . 0.0 111.002 -179.823 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 3.9 mm-40 -65.8 -48.19 72.57 Favored 'General case' 0 C--N 1.331 -0.201 0 C-N-CA 123.852 0.861 . . . . 0.0 110.351 -178.572 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 7.6 t70 -61.42 -43.5 98.77 Favored 'General case' 0 CA--C 1.514 -0.431 0 C-N-CA 124.176 0.99 . . . . 0.0 110.865 179.641 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 45.6 tt0 -61.85 -48.76 79.1 Favored 'General case' 0 N--CA 1.448 -0.554 0 C-N-CA 125.035 1.334 . . . . 0.0 108.568 179.697 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 79.8 m -56.79 -51.72 67.83 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 123.378 0.671 . . . . 0.0 109.222 179.185 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 82.3 mt -62.86 -41.66 93.46 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.41 0 C-N-CA 123.592 0.757 . . . . 0.0 110.296 -179.372 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 14.9 ttt180 -62.44 -52.22 64.39 Favored 'General case' 0 CA--C 1.517 -0.291 0 O-C-N 121.042 -1.036 . . . . 0.0 110.083 -179.928 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 5.0 mptp? -57.69 -47.85 81.2 Favored 'General case' 0 N--CA 1.452 -0.33 0 CA-C-O 118.626 -0.702 . . . . 0.0 109.348 -179.113 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 50.4 mttp -68.46 -35.12 77.11 Favored 'General case' 0 C--O 1.223 -0.29 0 CA-C-O 117.871 -1.061 . . . . 0.0 111.952 -179.173 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -60.81 -52.44 65.08 Favored 'General case' 0 C--N 1.332 -0.162 0 N-CA-C 106.845 -1.539 . . . . 0.0 106.845 177.844 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 8.5 tt0 -62.39 -38.96 91.64 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-N 115.856 -0.611 . . . . 0.0 111.728 -179.389 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 49.6 t0 -66.02 -42.68 89.31 Favored 'General case' 0 N--CA 1.466 0.355 0 N-CA-C 107.959 -1.126 . . . . 0.0 107.959 179.022 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 20.8 t -61.6 -33.27 73.62 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 125.488 1.515 . . . . 0.0 108.102 178.885 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 91.27 38.23 6.02 Favored Glycine 0 N--CA 1.447 -0.583 0 N-CA-C 107.776 -2.13 . . . . 0.0 107.776 -179.032 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 69.1 mt -138.56 159.31 42.42 Favored 'General case' 0 N--CA 1.447 -0.592 0 C-N-CA 126.596 1.958 . . . . 0.0 108.92 -179.17 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 1.7 t -82.37 154.81 25.05 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 104.698 -2.334 . . . . 0.0 104.698 176.906 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 37.4 t -44.93 -42.78 2.51 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.428 0 C-N-CA 126.466 1.907 . . . . 0.0 110.598 178.796 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 6.7 p -58.74 -51.86 68.17 Favored 'General case' 0 CA--C 1.531 0.244 0 CA-C-N 119.66 1.118 . . . . 0.0 111.644 179.52 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -61.15 -47.78 84.64 Favored 'General case' 0 N--CA 1.455 -0.196 0 C-N-CA 124.728 1.211 . . . . 0.0 109.731 179.195 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 77.3 t80 -55.32 -47.17 76.05 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 124.369 1.068 . . . . 0.0 109.5 179.581 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 3.0 mm -57.42 -66.53 0.32 Allowed 'Isoleucine or valine' 0 C--O 1.225 -0.225 0 C-N-CA 125.267 1.427 . . . . 0.0 110.03 179.327 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 9.2 ptm180 -54.37 -40.98 68.64 Favored 'General case' 0 C--O 1.22 -0.472 0 CA-C-O 118.001 -1.0 . . . . 0.0 112.914 -178.501 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 34.9 t30 -68.97 -45.12 71.47 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 119.642 1.11 . . . . 0.0 112.4 -179.339 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -64.76 -33.4 75.9 Favored 'General case' 0 C--O 1.224 -0.288 0 CA-C-N 118.468 0.576 . . . . 0.0 109.943 178.869 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -72.84 -14.25 61.46 Favored 'General case' 0 N--CA 1.453 -0.305 0 C-N-CA 124.199 0.999 . . . . 0.0 112.99 -179.375 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 20.7 mt -100.47 -40.88 7.23 Favored 'General case' 0 CA--C 1.509 -0.626 0 CA-C-O 118.277 -0.868 . . . . 0.0 109.9 178.826 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 70.0 m-80 . . . . . 0 C--O 1.251 1.178 0 O-C-N 124.455 1.097 . . . . 0.0 110.687 179.519 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 1' ' ' SER . . . . . . . . . . . . . 13.0 m . . . . . 0 CA--C 1.515 -0.38 0 N-CA-C 107.39 -1.337 . . . . 0.0 107.39 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 2' ' ' ASP . . . . . . . . . . . . . 6.4 p-10 -149.26 -153.92 0.52 Allowed 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 126.745 2.018 . . . . 0.0 107.076 -178.833 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 3' ' ' SER . . . . . . . . . . . . . 19.4 m -145.09 13.74 1.45 Allowed 'General case' 0 CA--C 1.541 0.606 0 CA-C-N 120.076 1.307 . . . . 0.0 113.489 179.947 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 4' ' ' ALA . . . . . . . . . . . . . . . -58.44 -22.79 55.6 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 124.871 1.268 . . . . 0.0 112.105 179.806 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 14.5 p -53.71 -20.88 4.1 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.555 0 C-N-CA 126.437 1.895 . . . . 0.0 112.337 179.323 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 6' ' ' ARG . . . . . . . . . . . . . 52.7 ptt85 -59.74 -15.8 22.7 Favored 'General case' 0 CA--C 1.535 0.383 0 O-C-N 120.931 -1.106 . . . . 0.0 113.172 179.171 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 16.9 pttp -143.75 158.59 43.57 Favored 'General case' 0 CA--C 1.528 0.1 0 C-N-CA 126.137 1.775 . . . . 0.0 107.508 -179.647 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 21.3 mtmt -112.27 4.7 17.91 Favored 'General case' 0 N--CA 1.465 0.32 0 C-N-CA 123.686 0.794 . . . . 0.0 112.906 -179.113 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 17.0 p -155.87 163.23 40.04 Favored 'General case' 0 C--O 1.238 0.489 0 C-N-CA 124.972 1.309 . . . . 0.0 108.668 179.32 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 10' ' ' GLU . . . . . . . . . . . . . 34.7 mt-10 -101.18 -175.53 2.89 Favored 'General case' 0 C--O 1.243 0.744 0 C-N-CA 125.261 1.424 . . . . 0.0 110.1 179.421 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 11' ' ' VAL . . . . . . . . . . . . . 16.3 t -137.49 91.54 0.81 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.549 0 C-N-CA 126.091 1.756 . . . . 0.0 107.967 -179.872 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 12' ' ' ARG . . . . . . . . . . . . . 17.2 mtp180 -138.73 169.0 18.59 Favored 'General case' 0 N--CA 1.468 0.43 0 C-N-CA 125.592 1.557 . . . . 0.0 109.426 179.331 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 13' ' ' GLN . . . . . . . . . . . . . 47.9 mt-30 -133.38 91.41 2.86 Favored 'General case' 0 N--CA 1.451 -0.383 0 C-N-CA 125.681 1.593 . . . . 0.0 107.019 179.111 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 20.9 ptmt -67.52 -17.74 64.78 Favored 'General case' 0 CA--C 1.536 0.421 0 N-CA-C 112.97 0.73 . . . . 0.0 112.97 179.305 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 10.9 t -92.46 -173.51 3.41 Favored 'General case' 0 N--CA 1.45 -0.458 0 C-N-CA 125.497 1.519 . . . . 0.0 108.435 178.522 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 2.8 t -136.12 88.9 0.75 Allowed 'Isoleucine or valine' 0 N--CA 1.447 -0.594 0 N-CA-C 106.948 -1.501 . . . . 0.0 106.948 -179.593 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 8.3 p -85.5 103.7 12.68 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.447 0 N-CA-C 104.751 -2.314 . . . . 0.0 104.751 178.689 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 36.1 ttt85 -137.66 165.57 26.06 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 108.376 -0.972 . . . . 0.0 108.376 -179.669 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 35.1 m -112.67 120.66 42.31 Favored 'General case' 0 N--CA 1.449 -0.483 0 N-CA-C 105.275 -2.12 . . . . 0.0 105.275 179.696 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -118.75 111.71 18.82 Favored 'General case' 0 CA--C 1.517 -0.317 0 C-N-CA 123.699 0.799 . . . . 0.0 109.686 -178.242 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 62.0 mtm180 -90.08 153.91 20.19 Favored 'General case' 0 N--CA 1.454 -0.259 0 CA-C-O 121.225 0.536 . . . . 0.0 111.283 179.362 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 22' ' ' PHE . . . . . . . . . . . . . 63.9 m-85 -139.33 162.36 35.19 Favored 'General case' 0 C--O 1.235 0.298 0 C-N-CA 126.833 2.053 . . . . 0.0 107.256 -179.588 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -94.86 177.82 1.7 Allowed Pre-proline 0 CA--C 1.546 0.824 0 N-CA-C 108.463 -0.939 . . . . 0.0 108.463 179.069 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 24' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -71.32 -23.47 24.03 Favored 'Trans proline' 0 N--CA 1.461 -0.402 0 C-N-CA 121.583 1.522 . . . . 0.0 114.458 -177.843 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 25' ' ' VAL . . . . . . . . . . . . . 98.6 t -75.35 -45.7 39.93 Favored 'Isoleucine or valine' 0 C--O 1.235 0.327 0 N-CA-C 107.608 -1.256 . . . . 0.0 107.608 179.823 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -63.67 -40.81 97.77 Favored 'General case' 0 N--CA 1.451 -0.419 0 CA-C-O 119.207 -0.425 . . . . 0.0 110.398 179.22 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 27' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -62.43 -48.08 81.23 Favored 'General case' 0 CA--C 1.51 -0.564 0 C-N-CA 123.289 0.635 . . . . 0.0 111.494 -179.702 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 28' ' ' GLU . . . . . . . . . . . . . 29.3 tt0 -60.34 -49.28 78.22 Favored 'General case' 0 N--CA 1.449 -0.524 0 N-CA-C 108.679 -0.859 . . . . 0.0 108.679 179.15 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 49.6 m -58.23 -57.21 13.89 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 122.701 0.4 . . . . 0.0 110.131 -179.818 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 55.4 mt -56.5 -47.23 82.12 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.272 0 C-N-CA 124.08 0.952 . . . . 0.0 110.888 -179.253 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 23.3 ttt-85 -62.23 -44.57 96.27 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 118.378 -0.82 . . . . 0.0 111.367 -178.922 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 1.7 mptm? -61.9 -50.89 70.37 Favored 'General case' 0 C--O 1.226 -0.167 0 CA-C-N 118.618 0.644 . . . . 0.0 109.406 179.4 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 4.6 mptp? -62.53 -42.69 99.69 Favored 'General case' 0 N--CA 1.466 0.354 0 C-N-CA 123.193 0.597 . . . . 0.0 111.57 -179.023 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 34' ' ' ALA . . . . . . . . . . . . . . . -58.6 -53.06 62.59 Favored 'General case' 0 N--CA 1.451 -0.405 0 C-N-CA 123.645 0.778 . . . . 0.0 109.521 179.436 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 14.1 tt0 -62.35 -39.97 94.86 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-O 118.689 -0.672 . . . . 0.0 111.335 -178.037 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 36' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -60.59 -46.57 89.75 Favored 'General case' 0 CA--C 1.516 -0.34 0 C-N-CA 126.385 1.874 . . . . 0.0 108.33 179.099 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 37' ' ' SER . . . . . . . . . . . . . 6.3 t -73.22 -14.35 61.32 Favored 'General case' 0 N--CA 1.451 -0.399 0 C-N-CA 120.935 -0.306 . . . . 0.0 110.934 -179.686 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 81.92 2.97 90.71 Favored Glycine 0 CA--C 1.528 0.9 0 CA-C-O 118.713 -1.048 . . . . 0.0 111.71 -179.479 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 39' ' ' LEU . . . . . . . . . . . . . 64.0 mt -100.2 123.36 44.33 Favored 'General case' 0 N--CA 1.445 -0.698 0 C-N-CA 127.627 2.371 . . . . 0.0 106.269 -179.4 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 40' ' ' THR . . . . . . . . . . . . . 11.7 t -54.38 153.63 5.3 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 108.791 -0.818 . . . . 0.0 108.791 178.753 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 41' ' ' VAL . . . . . . . . . . . . . 56.1 t -47.6 -43.35 9.25 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.326 0 C-N-CA 124.768 1.227 . . . . 0.0 111.874 -179.21 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 42' ' ' SER . . . . . . . . . . . . . 2.1 p -61.26 -44.95 96.41 Favored 'General case' 0 CA--C 1.535 0.366 0 O-C-N 121.499 -0.751 . . . . 0.0 111.392 179.397 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -65.63 -44.29 86.89 Favored 'General case' 0 C--O 1.224 -0.271 0 C-N-CA 123.587 0.755 . . . . 0.0 108.98 178.692 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 44' ' ' TYR . . . . . . . . . . . . . 64.2 t80 -53.79 -50.5 65.95 Favored 'General case' 0 N--CA 1.454 -0.262 0 C-N-CA 124.654 1.182 . . . . 0.0 109.955 179.684 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 45' ' ' ILE . . . . . . . . . . . . . 10.0 mm -55.41 -62.48 0.79 Allowed 'Isoleucine or valine' 0 N--CA 1.463 0.196 0 C-N-CA 123.984 0.914 . . . . 0.0 111.41 179.853 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 46' ' ' ARG . . . . . . . . . . . . . 7.3 ptm180 -56.89 -40.64 76.61 Favored 'General case' 0 C--O 1.223 -0.342 0 CA-C-O 119.041 -0.504 . . . . 0.0 111.03 -179.045 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 47' ' ' ASN . . . . . . . . . . . . . 24.3 t30 -60.75 -55.38 33.89 Favored 'General case' 0 N--CA 1.449 -0.51 0 C-N-CA 123.677 0.791 . . . . 0.0 110.417 -179.583 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -61.46 -31.23 71.18 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 123.783 0.833 . . . . 0.0 112.382 -179.659 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 49' ' ' ALA . . . . . . . . . . . . . . . -75.27 -21.17 58.73 Favored 'General case' 0 N--CA 1.447 -0.595 0 N-CA-C 113.807 1.04 . . . . 0.0 113.807 -179.322 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 20.8 mt -101.12 -36.09 9.09 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-N 118.577 0.626 . . . . 0.0 110.468 -179.883 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 51' ' ' ASN . . . . . . . . . . . . . 58.0 m-80 . . . . . 0 C--O 1.246 0.898 0 CA-C-O 117.319 -1.324 . . . . 0.0 110.103 179.88 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 15.6 m . . . . . 0 N--CA 1.482 1.174 0 N-CA-C 107.074 -1.454 . . . . 0.0 107.074 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -85.87 172.84 10.42 Favored 'General case' 0 N--CA 1.439 -0.982 0 C-N-CA 131.641 3.976 . . . . 0.0 110.835 -176.682 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 27.2 m -163.26 178.52 8.11 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 125.759 1.624 . . . . 0.0 108.41 179.778 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -61.12 110.13 1.29 Allowed 'General case' 0 N--CA 1.451 -0.39 0 C-N-CA 123.413 0.685 . . . . 0.0 109.45 179.409 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 14.5 p -60.01 -18.73 16.27 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.647 0 C-N-CA 125.276 1.43 . . . . 0.0 112.35 179.45 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 8.9 ptp85 40.05 62.71 1.21 Allowed 'General case' 0 C--N 1.343 0.289 0 C-N-CA 127.683 2.393 . . . . 0.0 111.689 179.865 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 1.3 tmtp? -89.91 -23.23 21.66 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-O 118.012 -0.994 . . . . 0.0 112.786 -179.541 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 41.6 mttp -150.25 -69.07 0.19 Allowed 'General case' 0 N--CA 1.465 0.323 0 CA-C-N 119.715 1.143 . . . . 0.0 111.197 -179.635 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . 0.254 94.6 p 67.03 -11.31 0.27 Allowed 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 128.284 2.634 . . . . 0.0 113.487 -178.35 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 15.3 pt-20 -64.37 -4.07 3.51 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 126.826 2.05 . . . . 0.0 113.626 179.049 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 17.7 m -99.24 19.51 2.2 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.702 0 C-N-CA 127.756 2.423 . . . . 0.0 110.938 179.026 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 12.5 tpt180 -151.5 92.35 1.76 Allowed 'General case' 0 C--O 1.235 0.341 0 O-C-N 120.285 -1.509 . . . . 0.0 107.896 178.985 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 11.8 pt20 -72.53 94.15 1.66 Allowed 'General case' 0 N--CA 1.455 -0.201 0 N-CA-C 109.685 -0.487 . . . . 0.0 109.685 179.692 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -69.81 -24.29 63.46 Favored 'General case' 0 CA--C 1.532 0.259 0 O-C-N 121.959 -0.463 . . . . 0.0 111.154 179.132 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 3.4 t -80.05 -170.54 2.51 Favored 'General case' 0 N--CA 1.44 -0.925 0 CA-C-O 123.342 1.544 . . . . 0.0 109.153 179.173 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 3.1 t -142.08 143.37 26.67 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.881 0 N-CA-C 102.993 -2.966 . . . . 0.0 102.993 178.328 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 8.6 p -139.04 119.73 15.25 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.064 0 N-CA-C 106.409 -1.7 . . . . 0.0 106.409 178.77 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 52.6 ttm-85 -139.08 158.31 44.41 Favored 'General case' 0 CA--C 1.51 -0.568 0 CA-C-N 114.773 -1.103 . . . . 0.0 109.3 179.487 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 19.6 m -104.74 97.43 7.32 Favored 'General case' 0 N--CA 1.445 -0.68 0 N-CA-C 100.379 -3.934 . . . . 0.0 100.379 178.05 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 53.3 tp -109.9 92.29 3.99 Favored 'General case' 0 N--CA 1.448 -0.532 0 C-N-CA 125.964 1.706 . . . . 0.0 111.537 -178.038 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.414 ' HA ' ' O ' ' B' ' 16' ' ' VAL . 8.3 mpt_? -66.78 156.08 36.47 Favored 'General case' 0 N--CA 1.44 -0.966 0 C-N-CA 123.94 0.896 . . . . 0.0 110.151 177.054 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 62.7 m-85 -131.48 147.53 52.56 Favored 'General case' 0 N--CA 1.466 0.355 0 N-CA-C 104.125 -2.546 . . . . 0.0 104.125 177.25 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 1.1 m -76.83 169.52 20.74 Favored Pre-proline 0 CA--C 1.545 0.757 0 N-CA-C 109.07 -0.715 . . . . 0.0 109.07 -179.004 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 59.5 Cg_endo -67.17 -32.25 34.27 Favored 'Trans proline' 0 C--N 1.345 0.377 0 C-N-CA 121.946 1.764 . . . . 0.0 113.584 -178.562 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 55.9 t -74.29 -49.31 32.83 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.174 0 N-CA-C 107.471 -1.307 . . . . 0.0 107.471 179.228 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 2.4 mp0 -56.24 -46.07 79.74 Favored 'General case' 0 N--CA 1.449 -0.514 0 C-N-CA 124.825 1.25 . . . . 0.0 108.976 179.578 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -62.26 -48.05 81.64 Favored 'General case' 0 CA--C 1.512 -0.51 0 C-N-CA 123.874 0.87 . . . . 0.0 111.999 179.58 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 39.7 tt0 -59.2 -48.4 81.75 Favored 'General case' 0 N--CA 1.452 -0.35 0 N-CA-C 108.896 -0.779 . . . . 0.0 108.896 -179.888 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 51.9 m -59.04 -55.18 38.45 Favored 'General case' 0 N--CA 1.455 -0.206 0 C-N-CA 123.585 0.754 . . . . 0.0 109.213 179.377 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 90.3 mt -58.5 -41.53 82.02 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.245 0 C-N-CA 123.327 0.651 . . . . 0.0 110.366 -179.176 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 54.5 ttt180 -60.62 -49.9 75.69 Favored 'General case' 0 N--CA 1.462 0.15 0 CA-C-N 119.301 0.955 . . . . 0.0 108.981 179.038 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 5.2 mptp? -58.16 -53.02 62.99 Favored 'General case' 0 C--O 1.225 -0.206 0 N-CA-C 109.077 -0.712 . . . . 0.0 109.077 179.578 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -59.99 -43.19 95.31 Favored 'General case' 0 CA--C 1.517 -0.304 0 C-N-CA 123.342 0.657 . . . . 0.0 112.173 -178.64 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -63.76 -48.63 76.17 Favored 'General case' 0 N--CA 1.446 -0.635 0 C-N-CA 124.441 1.096 . . . . 0.0 110.244 -179.787 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 27.7 tt0 -67.06 -32.92 74.43 Favored 'General case' 0 CA--C 1.533 0.297 0 O-C-N 121.364 -0.835 . . . . 0.0 110.877 179.891 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 8.1 t70 -70.17 -44.79 68.03 Favored 'General case' 0 CA--C 1.514 -0.437 0 C-N-CA 124.334 1.054 . . . . 0.0 108.857 -178.986 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 22.7 t -75.63 -9.8 58.9 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 124.78 1.232 . . . . 0.0 110.324 178.678 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 74.14 -6.89 18.91 Favored Glycine 0 CA--C 1.532 1.153 0 CA-C-O 118.845 -0.975 . . . . 0.0 111.014 -178.632 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 44.1 mt -88.41 119.17 28.59 Favored 'General case' 0 CA--C 1.513 -0.479 0 CA-C-N 119.89 1.845 . . . . 0.0 107.316 -179.429 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 5.2 t -48.37 151.36 1.08 Allowed 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 124.396 1.078 . . . . 0.0 109.768 178.884 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 41.6 t -46.72 -45.26 7.27 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.315 0 C-N-CA 125.018 1.327 . . . . 0.0 111.447 -178.762 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 54.3 m -61.2 -47.45 86.07 Favored 'General case' 0 CA--C 1.539 0.55 0 O-C-N 121.453 -0.78 . . . . 0.0 111.644 179.705 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -64.96 -44.16 90.29 Favored 'General case' 0 C--O 1.223 -0.317 0 C-N-CA 123.828 0.851 . . . . 0.0 109.36 178.787 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 80.8 t80 -55.12 -51.27 66.96 Favored 'General case' 0 N--CA 1.45 -0.471 0 C-N-CA 124.899 1.28 . . . . 0.0 109.837 179.725 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 12.1 mm -55.56 -65.86 0.33 Allowed 'Isoleucine or valine' 0 C--N 1.339 0.132 0 C-N-CA 124.897 1.279 . . . . 0.0 110.416 179.734 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 11.5 ptt180 -55.6 -44.94 77.45 Favored 'General case' 0 C--O 1.22 -0.452 0 CA-C-O 117.894 -1.05 . . . . 0.0 111.843 -178.241 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 30.8 t30 -58.35 -52.1 67.03 Favored 'General case' 0 CA--C 1.529 0.148 0 CA-C-N 119.322 0.964 . . . . 0.0 110.133 179.653 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -61.29 -30.84 70.73 Favored 'General case' 0 CA--C 1.533 0.316 0 N-CA-C 112.246 0.462 . . . . 0.0 112.246 179.749 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -82.37 -32.2 29.37 Favored 'General case' 0 C--O 1.222 -0.355 0 N-CA-C 114.817 1.414 . . . . 0.0 114.817 -178.969 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 22.1 mt -81.8 -41.58 20.92 Favored 'General case' 0 CA--C 1.508 -0.667 0 N-CA-C 113.944 1.09 . . . . 0.0 113.944 -177.551 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 69.5 m-80 . . . . . 0 C--O 1.251 1.141 0 CA-C-O 117.661 -1.162 . . . . 0.0 109.054 -178.896 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' 1' ' ' SER . . . . . . . . . . . . . 15.9 m . . . . . 0 N--CA 1.481 1.122 0 N-CA-C 106.959 -1.497 . . . . 0.0 106.959 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' 2' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -86.34 171.48 11.16 Favored 'General case' 0 N--CA 1.439 -1.003 1 C-N-CA 131.894 4.078 . . . . 0.0 109.953 -176.758 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 3' ' ' SER . . . . . . . . . . . . . 37.0 m -160.87 175.3 12.69 Favored 'General case' 0 C--O 1.234 0.271 0 C-N-CA 124.904 1.282 . . . . 0.0 108.872 179.87 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 4' ' ' ALA . . . . . . . . . . . . . . . -62.3 107.34 0.89 Allowed 'General case' 0 N--CA 1.452 -0.372 0 C-N-CA 124.075 0.95 . . . . 0.0 108.922 179.418 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 25.5 t -63.62 -26.15 40.02 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.473 0 C-N-CA 124.465 1.106 . . . . 0.0 111.697 -179.516 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 6' ' ' ARG . . . . . . . . . . . . . 85.3 mtt85 52.15 32.31 10.36 Favored 'General case' 0 N--CA 1.471 0.621 0 CA-C-N 119.705 1.138 . . . . 0.0 112.375 179.846 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 2.9 tmtt? -43.45 -23.65 0.07 Allowed 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 127.504 2.322 . . . . 0.0 115.571 -178.685 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 9.0 ptpp? -157.6 -35.88 0.07 Allowed 'General case' 0 C--N 1.332 -0.19 0 C-N-CA 125.111 1.364 . . . . 0.0 110.181 178.191 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 68.6 m 59.45 -21.33 0.03 OUTLIER 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 128.422 2.689 . . . . 0.0 116.735 179.547 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 10' ' ' GLU . . . . . . . . . . . . . 19.4 pt-20 -61.12 -18.16 56.56 Favored 'General case' 0 C--N 1.33 -0.263 0 C-N-CA 128.508 2.723 . . . . 0.0 115.619 -179.368 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 11' ' ' VAL . . . . . . . . . . . . . 16.0 m -70.73 -6.22 6.79 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.731 0 C-N-CA 127.857 2.463 . . . . 0.0 114.536 -178.906 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 12' ' ' ARG . . . . . . . . . . . . . 57.6 ttt85 -141.09 116.22 9.92 Favored 'General case' 0 C--O 1.236 0.344 0 CA-C-N 119.854 1.206 . . . . 0.0 108.744 179.26 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 13' ' ' GLN . . . . . . . . . . . . . 8.8 pt20 -78.89 96.91 5.81 Favored 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 123.414 0.685 . . . . 0.0 110.395 179.161 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -78.35 -38.31 42.32 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 106.517 -1.66 . . . . 0.0 106.517 177.557 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 1.3 t -73.53 164.94 25.97 Favored 'General case' 0 N--CA 1.444 -0.726 0 CA-C-O 122.032 0.92 . . . . 0.0 108.83 177.669 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 16' ' ' VAL . . . . . 0.414 ' O ' ' HA ' ' A' ' 21' ' ' ARG . 19.4 t -114.39 142.75 25.97 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.573 0 N-CA-C 105.771 -1.937 . . . . 0.0 105.771 179.325 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 12.4 p -135.8 108.93 9.17 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 N-CA-C 106.188 -1.782 . . . . 0.0 106.188 178.675 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 43.4 ttm-85 -134.38 150.04 50.87 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-N 115.855 -0.612 . . . . 0.0 110.1 -179.745 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 22.5 m -88.57 75.45 8.32 Favored 'General case' 0 N--CA 1.45 -0.459 0 C-N-CA 125.264 1.426 . . . . 0.0 108.265 179.801 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 16.6 tp -86.44 136.99 32.9 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 105.947 -1.872 . . . . 0.0 105.947 178.818 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 78.9 mtt180 -132.62 166.75 21.42 Favored 'General case' 0 N--CA 1.451 -0.42 0 C-N-CA 127.182 2.193 . . . . 0.0 110.094 -179.078 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 22' ' ' PHE . . . . . . . . . . . . . 87.6 m-85 -136.76 -178.04 5.01 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 124.611 1.164 . . . . 0.0 110.114 -179.721 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -105.83 173.48 3.2 Favored Pre-proline 0 CA--C 1.542 0.663 0 C-N-CA 124.181 0.992 . . . . 0.0 109.751 179.758 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 24' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -68.32 -37.83 12.99 Favored 'Trans proline' 0 C--N 1.347 0.471 0 C-N-CA 121.55 1.5 . . . . 0.0 114.371 -177.494 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 25' ' ' VAL . . . . . . . . . . . . . 81.6 t -74.97 -41.6 45.93 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.202 0 N-CA-C 108.793 -0.818 . . . . 0.0 108.793 179.489 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -60.39 -51.71 68.32 Favored 'General case' 0 N--CA 1.45 -0.469 0 C-N-CA 126.559 1.944 . . . . 0.0 109.941 -178.776 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 27' ' ' ASP . . . . . . . . . . . . . 16.8 t70 -61.11 -49.85 75.64 Favored 'General case' 0 CA--C 1.512 -0.515 0 C-N-CA 124.732 1.213 . . . . 0.0 110.676 179.601 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 28' ' ' GLU . . . . . . . . . . . . . 31.1 tt0 -58.85 -45.23 90.58 Favored 'General case' 0 N--CA 1.447 -0.601 0 N-CA-C 109.106 -0.701 . . . . 0.0 109.106 -179.757 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 99.1 m -59.97 -55.93 27.93 Favored 'General case' 0 CA--C 1.53 0.199 0 CA-C-N 118.677 0.671 . . . . 0.0 109.288 179.062 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 65.6 mt -55.6 -42.93 71.0 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.215 0 C-N-CA 123.012 0.525 . . . . 0.0 109.912 -179.76 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 77.3 ttt180 -64.41 -44.6 90.73 Favored 'General case' 0 N--CA 1.45 -0.442 0 CA-C-O 118.336 -0.84 . . . . 0.0 111.246 -179.185 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 1.6 mptp? -62.69 -47.19 84.73 Favored 'General case' 0 C--O 1.222 -0.363 0 CA-C-O 118.101 -0.952 . . . . 0.0 109.062 179.579 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 1.5 mptm? -61.83 -47.82 83.37 Favored 'General case' 0 CA--C 1.518 -0.272 0 CA-C-N 119.48 1.036 . . . . 0.0 110.369 -179.736 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 34' ' ' ALA . . . . . . . . . . . . . . . -54.63 -57.86 9.79 Favored 'General case' 0 N--CA 1.448 -0.554 0 C-N-CA 124.94 1.296 . . . . 0.0 109.866 179.456 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 41.3 tt0 -61.81 -41.59 97.95 Favored 'General case' 0 N--CA 1.464 0.273 0 C-N-CA 124.649 1.18 . . . . 0.0 112.271 -178.946 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 36' ' ' ASP . . . . . . . . . . . . . 4.8 t70 -61.02 -42.32 98.24 Favored 'General case' 0 C--N 1.332 -0.184 0 C-N-CA 124.613 1.165 . . . . 0.0 108.393 179.617 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 37' ' ' SER . . . . . . . . . . . . . 29.5 t -77.68 -7.82 57.01 Favored 'General case' 0 N--CA 1.445 -0.684 0 C-N-CA 124.598 1.159 . . . . 0.0 110.839 179.107 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 77.13 15.05 81.97 Favored Glycine 0 CA--C 1.523 0.563 0 CA-C-O 117.061 -1.966 . . . . 0.0 115.998 178.895 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 39' ' ' LEU . . . . . . . . . . . . . 8.3 mt -120.68 143.37 48.76 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-N 120.892 2.346 . . . . 0.0 106.214 179.542 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 40' ' ' THR . . . . . . . . . . . . . 10.1 t -63.85 152.16 40.42 Favored 'General case' 0 C--N 1.321 -0.671 0 O-C-N 120.964 -1.085 . . . . 0.0 108.393 178.939 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 41' ' ' VAL . . . . . . . . . . . . . 52.6 t -48.07 -42.02 10.27 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.254 0 C-N-CA 125.267 1.427 . . . . 0.0 111.452 179.319 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 42' ' ' SER . . . . . . . . . . . . . 70.7 m -57.94 -43.09 86.14 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-N 120.301 1.409 . . . . 0.0 111.716 179.923 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -65.11 -51.04 63.63 Favored 'General case' 0 N--CA 1.452 -0.345 0 N-CA-C 107.529 -1.286 . . . . 0.0 107.529 178.087 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 44' ' ' TYR . . . . . . . . . . . . . 69.5 t80 -53.98 -45.71 71.49 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 123.548 0.739 . . . . 0.0 111.362 -179.647 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 45' ' ' ILE . . . . . . . . . . . . . 16.0 mm -59.47 -68.43 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.34 0.184 0 C-N-CA 125.352 1.461 . . . . 0.0 109.904 179.718 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 46' ' ' ARG . . . . . . . . . . . . . 17.8 ptt85 -51.65 -44.92 63.18 Favored 'General case' 0 C--O 1.219 -0.538 0 CA-C-O 118.971 -0.538 . . . . 0.0 110.537 -178.373 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 47' ' ' ASN . . . . . . . . . . . . . 32.4 t30 -62.43 -47.78 82.56 Favored 'General case' 0 N--CA 1.444 -0.758 0 CA-C-O 117.639 -1.172 . . . . 0.0 112.47 -179.008 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -64.41 -29.14 70.2 Favored 'General case' 0 CA--C 1.531 0.237 0 CA-C-N 119.115 0.87 . . . . 0.0 110.514 179.544 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 49' ' ' ALA . . . . . . . . . . . . . . . -73.75 -21.28 60.25 Favored 'General case' 0 CA--C 1.539 0.522 0 N-CA-C 112.494 0.554 . . . . 0.0 112.494 179.575 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 6.3 mt -101.33 -33.79 9.88 Favored 'General case' 0 N--CA 1.463 0.223 0 C-N-CA 124.532 1.133 . . . . 0.0 109.783 -179.085 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 51' ' ' ASN . . . . . . . . . . . . . 69.4 m-80 . . . . . 0 C--O 1.253 1.263 0 C-N-CA 125.671 1.589 . . . . 0.0 109.11 178.984 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 13.0 m . . . . . 0 N--CA 1.483 1.186 0 CA-C-O 122.873 1.32 . . . . 0.0 108.402 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -80.87 -17.96 48.93 Favored 'General case' 0 C--N 1.321 -0.655 1 C-N-CA 133.501 4.72 . . . . 0.0 111.974 -177.108 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 6.1 t -176.8 172.22 2.1 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 129.74 3.216 . . . . 0.0 105.104 179.378 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -143.13 168.83 18.81 Favored 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 124.657 1.183 . . . . 0.0 108.956 178.656 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 28.8 m -93.72 -178.56 0.44 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.489 0 C-N-CA 124.409 1.084 . . . . 0.0 111.004 -179.4 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -134.8 132.53 38.8 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 124.485 1.114 . . . . 0.0 110.384 -179.21 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 26.5 mtpp -120.55 118.47 30.28 Favored 'General case' 0 C--O 1.233 0.215 0 N-CA-C 106.498 -1.667 . . . . 0.0 106.498 178.824 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 9.4 mtmp? -71.78 159.64 33.99 Favored 'General case' 0 CA--C 1.521 -0.163 0 C-N-CA 123.636 0.774 . . . . 0.0 112.435 -178.684 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 7.4 p -78.42 -27.78 46.64 Favored 'General case' 0 N--CA 1.447 -0.577 0 C-N-CA 125.201 1.4 . . . . 0.0 112.262 179.355 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 28.4 mm-40 -138.43 158.47 44.21 Favored 'General case' 0 C--O 1.239 0.523 0 C-N-CA 125.955 1.702 . . . . 0.0 111.488 -179.094 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 2.2 p -133.58 -42.78 0.53 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.31 0 C-N-CA 126.507 1.923 . . . . 0.0 110.381 179.596 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 50.1 ttt85 -61.54 -56.49 19.44 Favored 'General case' 0 C--O 1.231 0.122 0 C-N-CA 125.134 1.373 . . . . 0.0 111.244 -179.386 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 38.7 mt-30 -124.35 91.71 3.51 Favored 'General case' 0 CA--C 1.52 -0.178 0 N-CA-C 108.464 -0.939 . . . . 0.0 108.464 179.347 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 13.4 ptmm? -68.04 -32.44 72.81 Favored 'General case' 0 C--O 1.223 -0.326 0 N-CA-C 109.841 -0.429 . . . . 0.0 109.841 178.686 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 3.9 t -86.8 161.53 18.3 Favored 'General case' 0 N--CA 1.447 -0.587 0 N-CA-C 108.605 -0.887 . . . . 0.0 108.605 179.245 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 4.1 t -109.0 138.77 34.58 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.635 0 N-CA-C 103.65 -2.722 . . . . 0.0 103.65 178.164 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 11.5 p -140.73 117.26 7.9 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.388 0 N-CA-C 106.639 -1.615 . . . . 0.0 106.639 178.89 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 33.3 ttt180 -150.19 173.31 14.07 Favored 'General case' 0 C--O 1.236 0.375 0 N-CA-C 107.835 -1.172 . . . . 0.0 107.835 -179.782 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 27.1 m -111.46 120.35 41.87 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 104.895 -2.261 . . . . 0.0 104.895 179.078 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -120.62 104.68 10.12 Favored 'General case' 0 N--CA 1.449 -0.511 0 N-CA-C 106.32 -1.733 . . . . 0.0 106.32 179.484 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 26.3 mtm-85 -84.98 157.16 20.86 Favored 'General case' 0 N--CA 1.448 -0.543 0 N-CA-C 109.662 -0.495 . . . . 0.0 109.662 178.874 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 97.5 m-85 -137.66 163.42 31.3 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 108.321 -0.992 . . . . 0.0 108.321 179.936 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 19.3 m -91.98 168.3 13.32 Favored Pre-proline 0 CA--C 1.547 0.834 0 CA-C-O 118.154 -0.927 . . . . 0.0 108.53 179.734 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 45.8 Cg_endo -63.14 -41.97 25.41 Favored 'Trans proline' 0 C--N 1.348 0.529 0 C-N-CA 121.72 1.613 . . . . 0.0 113.03 -177.499 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 65.6 t -68.2 -26.61 34.52 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.363 0 C-N-CA 123.963 0.905 . . . . 0.0 110.561 -179.654 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 4.2 mm-40 -81.65 -38.12 26.42 Favored 'General case' 0 C--N 1.333 -0.124 0 C-N-CA 124.083 0.953 . . . . 0.0 109.572 -179.297 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -69.04 -44.08 73.38 Favored 'General case' 0 C--O 1.221 -0.416 0 C-N-CA 125.429 1.492 . . . . 0.0 108.636 178.626 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 24.6 tt0 -54.22 -52.32 61.64 Favored 'General case' 0 N--CA 1.451 -0.382 0 C-N-CA 126.615 1.966 . . . . 0.0 109.455 179.064 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 72.8 m -65.79 -52.01 54.31 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-O 118.969 -0.538 . . . . 0.0 110.915 -179.4 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 71.1 mt -58.53 -41.75 82.71 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.261 0 CA-C-N 118.191 0.451 . . . . 0.0 110.611 -178.694 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 50.7 ttt85 -64.94 -48.66 73.32 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-O 118.868 -0.586 . . . . 0.0 110.352 -179.516 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 11.7 mptt -63.87 -46.88 82.97 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-O 118.737 -0.649 . . . . 0.0 111.002 -179.243 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.8 -43.38 98.95 Favored 'General case' 0 C--O 1.228 -0.041 0 CA-C-N 118.63 0.65 . . . . 0.0 110.218 -179.508 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -59.16 -52.74 64.42 Favored 'General case' 0 N--CA 1.454 -0.25 0 C-N-CA 123.842 0.857 . . . . 0.0 110.128 179.455 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 18.0 tt0 -59.39 -39.25 82.74 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 123.392 0.677 . . . . 0.0 111.784 -178.896 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -71.3 -40.91 70.56 Favored 'General case' 0 N--CA 1.463 0.196 0 CA-C-N 118.416 0.553 . . . . 0.0 109.913 178.841 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 23.1 t -69.38 -9.04 51.72 Favored 'General case' 0 N--CA 1.448 -0.542 0 C-N-CA 123.606 0.762 . . . . 0.0 110.66 179.788 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 67.42 20.74 71.88 Favored Glycine 0 CA--C 1.527 0.83 0 CA-C-N 119.061 0.846 . . . . 0.0 111.064 -179.203 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 70.6 mt -117.71 116.79 27.74 Favored 'General case' 0 CA--C 1.513 -0.474 0 N-CA-C 104.148 -2.538 . . . . 0.0 104.148 179.791 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 5.2 t -54.24 152.2 6.48 Favored 'General case' 0 CA--C 1.539 0.533 0 N-CA-C 108.551 -0.907 . . . . 0.0 108.551 179.171 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 53.1 t -45.71 -43.25 4.08 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.224 0 C-N-CA 124.02 0.928 . . . . 0.0 111.629 -179.479 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 8.9 p -59.35 -47.03 86.94 Favored 'General case' 0 CA--C 1.536 0.42 0 O-C-N 121.58 -0.7 . . . . 0.0 111.614 -179.954 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -67.01 -43.25 83.36 Favored 'General case' 0 N--CA 1.454 -0.226 0 C-N-CA 124.454 1.102 . . . . 0.0 109.967 178.992 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 36.2 t80 -53.74 -51.38 63.54 Favored 'General case' 0 N--CA 1.453 -0.319 0 C-N-CA 125.265 1.426 . . . . 0.0 109.137 179.684 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 8.3 mm -53.82 -63.21 0.55 Allowed 'Isoleucine or valine' 0 CA--C 1.529 0.14 0 C-N-CA 124.668 1.187 . . . . 0.0 110.093 179.733 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 6.9 ptm180 -56.83 -44.99 82.6 Favored 'General case' 0 C--O 1.224 -0.28 0 CA-C-O 118.296 -0.859 . . . . 0.0 112.718 -178.744 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 25.5 t30 -59.55 -53.07 62.38 Favored 'General case' 0 C--O 1.232 0.143 0 C-N-CA 124.449 1.1 . . . . 0.0 110.468 -179.912 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -62.67 -33.09 74.36 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 123.316 0.646 . . . . 0.0 111.324 179.834 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -75.26 -15.34 60.53 Favored 'General case' 0 CA--C 1.536 0.421 0 N-CA-C 114.128 1.158 . . . . 0.0 114.128 -179.673 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 17.6 mt -107.05 -34.77 7.07 Favored 'General case' 0 CA--C 1.517 -0.297 0 CA-C-N 119.426 1.012 . . . . 0.0 112.418 -179.889 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 56.2 m-80 . . . . . 0 C--O 1.247 0.968 0 C-N-CA 123.654 0.782 . . . . 0.0 111.595 -178.981 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 1' ' ' SER . . . . . . . . . . . . . 12.3 m . . . . . 0 N--CA 1.483 1.211 0 CA-C-O 122.85 1.309 . . . . 0.0 108.494 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 2' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -77.15 -32.21 56.15 Favored 'General case' 0 C--N 1.319 -0.747 1 C-N-CA 133.344 4.657 . . . . 0.0 111.383 -177.247 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 3' ' ' SER . . . . . . . . . . . . . 5.1 t -159.53 179.26 9.07 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 126.93 2.092 . . . . 0.0 106.463 179.134 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 4' ' ' ALA . . . . . . . . . . . . . . . -140.36 -176.78 4.75 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 124.931 1.292 . . . . 0.0 110.853 -179.535 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 16.7 m -129.08 158.16 41.79 Favored 'Isoleucine or valine' 0 C--O 1.239 0.537 0 C-N-CA 126.053 1.741 . . . . 0.0 108.449 179.435 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 6' ' ' ARG . . . . . . . . . . . . . 25.4 mmt180 -120.36 163.0 18.52 Favored 'General case' 0 N--CA 1.464 0.274 0 C-N-CA 123.578 0.751 . . . . 0.0 110.118 -179.576 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 20.8 mttp -142.4 132.44 24.51 Favored 'General case' 0 C--N 1.331 -0.199 0 C-N-CA 126.205 1.802 . . . . 0.0 106.268 179.496 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 7.1 mtmp? -71.51 163.06 28.44 Favored 'General case' 0 C--O 1.236 0.38 0 CA-C-N 118.292 0.496 . . . . 0.0 110.408 -179.729 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 5.3 p -71.25 -76.94 0.1 Allowed 'General case' 0 N--CA 1.45 -0.459 0 C-N-CA 124.881 1.273 . . . . 0.0 109.111 179.332 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 10' ' ' GLU . . . . . . . . . . . . . 51.4 mm-40 -76.24 168.66 19.65 Favored 'General case' 0 C--O 1.236 0.374 0 C-N-CA 124.579 1.152 . . . . 0.0 112.141 -179.391 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 11' ' ' VAL . . . . . . . . . . . . . 33.9 m -132.24 -50.88 0.76 Allowed 'Isoleucine or valine' 0 C--O 1.236 0.392 0 C-N-CA 125.629 1.571 . . . . 0.0 110.396 179.245 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 12' ' ' ARG . . . . . . . . . . . . . 28.8 ttt85 -65.63 -52.65 50.3 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-N 119.132 0.878 . . . . 0.0 111.474 -178.269 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 13' ' ' GLN . . . . . . . . . . . . . 47.4 mt-30 -135.17 99.65 4.32 Favored 'General case' 0 CA--C 1.517 -0.294 0 C-N-CA 123.941 0.896 . . . . 0.0 108.677 178.91 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 10.4 ptmm? -62.31 -33.74 75.26 Favored 'General case' 0 C--O 1.225 -0.226 0 CA-C-N 115.638 -0.71 . . . . 0.0 109.881 178.356 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 4.1 t -89.21 157.24 18.32 Favored 'General case' 0 N--CA 1.439 -0.985 0 C-N-CA 124.327 1.051 . . . . 0.0 110.548 -179.618 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 36.0 t -101.51 152.42 5.27 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 N-CA-C 105.409 -2.071 . . . . 0.0 105.409 178.422 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 11.1 p -147.66 110.82 0.72 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 N-CA-C 103.501 -2.777 . . . . 0.0 103.501 178.121 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 32.2 ttt180 -145.0 158.71 43.73 Favored 'General case' 0 C--O 1.233 0.197 0 O-C-N 121.274 -0.891 . . . . 0.0 113.299 -178.425 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 3.9 m -92.23 80.18 5.03 Favored 'General case' 0 N--CA 1.451 -0.377 0 C-N-CA 125.998 1.719 . . . . 0.0 107.812 -179.361 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -85.62 93.02 8.72 Favored 'General case' 0 C--N 1.326 -0.439 0 O-C-N 121.32 -0.863 . . . . 0.0 109.102 -179.453 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 14.5 mmm-85 -78.44 154.2 30.82 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 122.987 0.515 . . . . 0.0 110.179 179.101 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 22' ' ' PHE . . . . . . . . . . . . . 92.0 m-85 -141.35 174.18 10.78 Favored 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 125.506 1.522 . . . . 0.0 108.269 179.139 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 23' ' ' SER . . . . . 0.448 ' HB3' ' HD2' ' B' ' 24' ' ' PRO . 3.2 m -104.25 176.66 1.67 Allowed Pre-proline 0 CA--C 1.544 0.716 0 CA-C-O 117.809 -1.091 . . . . 0.0 110.124 179.562 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 24' ' ' PRO . . . . . 0.448 ' HD2' ' HB3' ' B' ' 23' ' ' SER . 85.7 Cg_endo -77.17 -29.0 5.35 Favored 'Trans proline' 0 C--N 1.35 0.62 0 CA-C-N 121.519 1.578 . . . . 0.0 112.634 -178.107 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 25' ' ' VAL . . . . . . . . . . . . . 11.4 t -75.66 -34.66 29.34 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.177 0 N-CA-C 107.295 -1.372 . . . . 0.0 107.295 179.237 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -69.08 -45.63 69.8 Favored 'General case' 0 N--CA 1.447 -0.595 0 N-CA-C 107.48 -1.304 . . . . 0.0 107.48 178.41 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 27' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -60.7 -49.3 78.05 Favored 'General case' 0 C--O 1.218 -0.601 0 N-CA-C 109.194 -0.669 . . . . 0.0 109.194 179.097 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 28' ' ' GLU . . . . . . . . . . . . . 36.4 tt0 -61.32 -23.03 65.43 Favored 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 123.965 0.906 . . . . 0.0 111.48 -179.806 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 88.6 m -85.21 -53.92 4.94 Favored 'General case' 0 N--CA 1.452 -0.35 0 N-CA-C 108.035 -1.098 . . . . 0.0 108.035 178.616 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 58.8 mt -58.43 -46.16 89.57 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.507 0 C-N-CA 124.591 1.156 . . . . 0.0 110.18 -179.278 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 54.0 ttt85 -59.98 -52.33 65.87 Favored 'General case' 0 N--CA 1.451 -0.387 0 C-N-CA 124.299 1.04 . . . . 0.0 110.142 -179.456 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 5.9 mptt -59.42 -48.44 81.65 Favored 'General case' 0 N--CA 1.456 -0.164 0 O-C-N 123.711 0.632 . . . . 0.0 110.499 -179.073 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -67.02 -38.46 86.0 Favored 'General case' 0 C--O 1.226 -0.158 0 CA-C-N 118.123 0.42 . . . . 0.0 112.085 -178.586 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 34' ' ' ALA . . . . . . . . . . . . . . . -59.94 -52.81 63.82 Favored 'General case' 0 N--CA 1.452 -0.371 0 C-N-CA 124.015 0.926 . . . . 0.0 108.79 179.034 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 5.9 tt0 -65.73 -30.84 71.57 Favored 'General case' 0 CA--C 1.534 0.348 0 O-C-N 122.217 -0.302 . . . . 0.0 110.755 -178.962 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 36' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -67.32 -42.29 83.86 Favored 'General case' 0 N--CA 1.462 0.147 0 C-N-CA 124.264 1.026 . . . . 0.0 108.242 178.697 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 37' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -74.51 -21.57 59.48 Favored 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 124.356 1.063 . . . . 0.0 110.675 178.781 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 85.56 -5.93 81.91 Favored Glycine 0 CA--C 1.537 1.428 0 N-CA-C 109.71 -1.356 . . . . 0.0 109.71 -177.688 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 39' ' ' LEU . . . . . . . . . . . . . 84.4 mt -89.01 110.27 20.99 Favored 'General case' 0 N--CA 1.445 -0.687 0 C-N-CA 128.144 2.578 . . . . 0.0 105.68 179.312 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 40' ' ' THR . . . . . . . . . . . . . 5.0 t -48.04 155.2 0.47 Allowed 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 123.777 0.831 . . . . 0.0 109.589 178.184 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 41' ' ' VAL . . . . . . . . . . . . . 52.9 t -45.65 -43.2 3.95 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.505 0 C-N-CA 124.479 1.112 . . . . 0.0 111.441 -179.392 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 42' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -64.26 -35.64 81.49 Favored 'General case' 0 CA--C 1.542 0.638 0 O-C-N 121.487 -0.758 . . . . 0.0 112.93 179.823 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -76.25 -44.51 37.09 Favored 'General case' 0 C--O 1.226 -0.162 0 C-N-CA 126.277 1.831 . . . . 0.0 108.957 178.579 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 44' ' ' TYR . . . . . . . . . . . . . 64.0 t80 -55.69 -51.93 65.59 Favored 'General case' 0 N--CA 1.446 -0.659 0 C-N-CA 124.812 1.245 . . . . 0.0 109.256 179.5 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 45' ' ' ILE . . . . . . . . . . . . . 21.6 mm -54.96 -60.43 1.6 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.395 0 C-N-CA 123.86 0.864 . . . . 0.0 111.739 179.653 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 46' ' ' ARG . . . . . . . . . . . . . 3.3 ptm180 -53.91 -45.58 71.21 Favored 'General case' 0 C--O 1.224 -0.246 0 CA-C-O 118.429 -0.796 . . . . 0.0 111.368 -179.508 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 47' ' ' ASN . . . . . . . . . . . . . 27.4 t30 -62.24 -57.02 12.96 Favored 'General case' 0 N--CA 1.452 -0.343 0 C-N-CA 124.939 1.296 . . . . 0.0 110.878 -179.473 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -58.13 -30.58 66.44 Favored 'General case' 0 C--N 1.334 -0.093 0 C-N-CA 123.891 0.876 . . . . 0.0 113.264 -178.725 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 49' ' ' ALA . . . . . . . . . . . . . . . -82.58 -29.35 30.31 Favored 'General case' 0 N--CA 1.451 -0.41 0 N-CA-C 114.274 1.213 . . . . 0.0 114.274 -179.208 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 43.7 mt -84.88 -37.6 20.43 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-N 119.084 0.856 . . . . 0.0 111.171 -179.234 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 51' ' ' ASN . . . . . . . . . . . . . 63.5 m-20 . . . . . 0 C--O 1.251 1.149 0 CA-C-O 116.576 -1.678 . . . . 0.0 110.324 179.33 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 10.8 m . . . . . 0 CA--C 1.512 -0.506 0 N-CA-C 107.163 -1.421 . . . . 0.0 107.163 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -58.61 -50.82 72.41 Favored 'General case' 0 C--N 1.323 -0.559 0 C-N-CA 128.21 2.604 . . . . 0.0 109.924 -178.988 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 9.8 p -163.21 -84.05 0.03 OUTLIER 'General case' 0 N--CA 1.454 -0.265 0 N-CA-C 107.936 -1.135 . . . . 0.0 107.936 178.904 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -143.09 177.07 8.63 Favored 'General case' 0 CA--C 1.53 0.189 0 C-N-CA 125.776 1.63 . . . . 0.0 109.11 179.744 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 8.6 p -143.68 170.34 9.61 Favored 'Isoleucine or valine' 0 C--O 1.238 0.495 0 N-CA-C 108.242 -1.022 . . . . 0.0 108.242 179.814 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 4.3 ptp180 -141.35 162.26 35.9 Favored 'General case' 0 C--N 1.333 -0.145 0 C-N-CA 125.399 1.48 . . . . 0.0 108.564 179.347 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 12.2 pttp -167.89 174.47 7.45 Favored 'General case' 0 C--N 1.328 -0.329 0 C-N-CA 126.086 1.754 . . . . 0.0 107.098 179.485 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 35.4 mtpt -62.33 131.3 48.87 Favored 'General case' 0 CA--C 1.535 0.373 0 N-CA-C 103.511 -2.774 . . . . 0.0 103.511 175.905 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -119.17 -67.94 0.95 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 119.845 1.202 . . . . 0.0 107.921 179.684 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 21.1 mt-10 -143.31 172.11 13.21 Favored 'General case' 0 C--O 1.239 0.53 0 C-N-CA 125.802 1.641 . . . . 0.0 108.286 179.605 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -162.64 134.38 0.96 Allowed 'Isoleucine or valine' 0 C--O 1.239 0.533 0 C-N-CA 125.22 1.408 . . . . 0.0 107.23 178.338 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 6.7 ttm180 -166.44 -172.89 2.33 Favored 'General case' 0 C--O 1.241 0.658 0 N-CA-C 105.805 -1.924 . . . . 0.0 105.805 178.932 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 8.8 mp0 -82.0 76.04 8.91 Favored 'General case' 0 N--CA 1.453 -0.294 0 N-CA-C 108.44 -0.948 . . . . 0.0 108.44 179.752 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 44.6 pttt -64.18 -33.46 75.84 Favored 'General case' 0 C--O 1.221 -0.414 0 C-N-CA 123.833 0.853 . . . . 0.0 109.906 178.476 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 4.1 t -81.06 165.09 21.97 Favored 'General case' 0 N--CA 1.437 -1.097 0 CA-C-O 122.161 0.981 . . . . 0.0 108.355 178.902 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 24.7 t -109.71 147.03 14.39 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.763 0 N-CA-C 104.437 -2.431 . . . . 0.0 104.437 176.665 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 11.3 p -143.44 105.45 1.01 Allowed 'Isoleucine or valine' 0 N--CA 1.445 -0.709 0 N-CA-C 104.431 -2.433 . . . . 0.0 104.431 178.198 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 49.5 ttm-85 -148.34 156.02 42.0 Favored 'General case' 0 C--N 1.325 -0.462 0 C-N-CA 123.245 0.618 . . . . 0.0 109.743 -179.344 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 23.4 m -103.62 129.7 50.94 Favored 'General case' 0 N--CA 1.451 -0.402 0 N-CA-C 104.07 -2.567 . . . . 0.0 104.07 178.445 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -135.98 111.66 9.36 Favored 'General case' 0 N--CA 1.453 -0.322 0 N-CA-C 108.163 -1.051 . . . . 0.0 108.163 -178.413 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 89.4 mtm-85 -86.06 138.93 31.58 Favored 'General case' 0 N--CA 1.462 0.168 0 CA-C-O 117.369 -1.3 . . . . 0.0 112.345 -178.805 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 32.2 m-85 -123.0 159.39 28.47 Favored 'General case' 0 N--CA 1.481 1.112 0 C-N-CA 127.12 2.168 . . . . 0.0 110.195 -178.62 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . 0.401 ' HB3' ' HD2' ' A' ' 24' ' ' PRO . 1.9 m -80.75 167.72 30.48 Favored Pre-proline 0 CA--C 1.541 0.614 0 CA-C-N 119.097 0.862 . . . . 0.0 109.691 179.7 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . 0.401 ' HD2' ' HB3' ' A' ' 23' ' ' SER . 41.8 Cg_endo -65.25 -42.17 14.19 Favored 'Trans proline' 0 N--CA 1.459 -0.535 0 C-N-CA 121.929 1.752 . . . . 0.0 112.373 -179.653 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 77.1 t -58.39 -53.07 51.47 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.315 0 N-CA-C 108.075 -1.083 . . . . 0.0 108.075 179.757 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 -56.84 -46.03 81.98 Favored 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 124.451 1.1 . . . . 0.0 110.863 179.453 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 19.3 t70 -60.24 -50.1 75.01 Favored 'General case' 0 CA--C 1.512 -0.511 0 C-N-CA 124.072 0.949 . . . . 0.0 112.549 -179.618 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -60.24 -43.61 95.93 Favored 'General case' 0 N--CA 1.452 -0.338 0 N-CA-C 109.645 -0.502 . . . . 0.0 109.645 -179.783 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 63.1 m -58.71 -54.42 47.29 Favored 'General case' 0 N--CA 1.451 -0.385 0 N-CA-C 109.293 -0.632 . . . . 0.0 109.293 179.448 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 78.3 mt -58.14 -45.58 88.56 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.362 0 C-N-CA 123.008 0.523 . . . . 0.0 109.727 -179.673 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 29.1 ttt180 -61.65 -43.61 98.53 Favored 'General case' 0 C--N 1.334 -0.076 0 O-C-N 121.358 -0.839 . . . . 0.0 112.225 -178.941 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -68.81 -47.69 65.46 Favored 'General case' 0 CA--C 1.528 0.127 0 CA-C-N 118.915 0.78 . . . . 0.0 109.922 -179.7 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 71.8 mmtt -63.93 -46.42 84.82 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-N 118.819 0.736 . . . . 0.0 112.098 -178.885 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -60.01 -52.48 65.19 Favored 'General case' 0 N--CA 1.448 -0.549 0 C-N-CA 122.53 0.332 . . . . 0.0 110.614 -179.482 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 26.9 tp10 -62.8 -37.35 86.37 Favored 'General case' 0 N--CA 1.454 -0.263 0 CA-C-N 116.594 -0.276 . . . . 0.0 111.4 -178.646 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -63.79 -38.89 92.79 Favored 'General case' 0 CA--C 1.527 0.059 0 N-CA-C 108.685 -0.857 . . . . 0.0 108.685 179.282 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 33.1 t -75.19 -10.45 59.48 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 123.76 0.824 . . . . 0.0 110.725 178.69 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 77.77 4.02 84.7 Favored Glycine 0 CA--C 1.528 0.861 0 O-C-N 120.791 -1.193 . . . . 0.0 113.246 179.365 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 1.8 mt -118.66 115.86 25.39 Favored 'General case' 0 CA--C 1.508 -0.656 0 N-CA-C 102.685 -3.08 . . . . 0.0 102.685 179.448 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 3.1 t -46.72 160.54 0.08 Allowed 'General case' 0 C--N 1.323 -0.552 0 C-N-CA 125.615 1.566 . . . . 0.0 112.499 -179.031 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 9.2 m -47.06 -38.39 4.36 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.591 0 N-CA-C 114.13 1.159 . . . . 0.0 114.13 -177.72 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . 0.44 ' HA ' HD11 ' B' ' 20' ' ' LEU . 6.9 p -66.05 -52.2 51.24 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-N 119.485 1.039 . . . . 0.0 109.898 179.153 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -56.88 -43.44 81.27 Favored 'General case' 0 CA--C 1.531 0.223 0 C-N-CA 124.185 0.994 . . . . 0.0 109.356 178.185 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 83.3 t80 -58.51 -52.28 66.32 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 124.04 0.936 . . . . 0.0 108.952 178.794 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 2.4 mm -53.39 -63.8 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.343 0.308 0 C-N-CA 126.176 1.79 . . . . 0.0 110.011 179.76 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 2.4 ptm180 -56.13 -43.02 77.8 Favored 'General case' 0 CA--C 1.516 -0.347 0 CA-C-O 117.675 -1.155 . . . . 0.0 111.637 -178.693 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 9.3 t30 -61.3 -54.71 40.51 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 119.459 1.027 . . . . 0.0 110.49 179.368 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -60.16 -32.92 71.5 Favored 'General case' 0 C--O 1.224 -0.282 0 C-N-CA 123.479 0.712 . . . . 0.0 112.157 -179.17 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -71.39 -27.04 63.04 Favored 'General case' 0 CA--C 1.535 0.382 0 N-CA-C 112.975 0.732 . . . . 0.0 112.975 -179.663 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 19.4 mt -92.48 -35.66 13.51 Favored 'General case' 0 CA--C 1.518 -0.267 0 C-N-CA 123.413 0.685 . . . . 0.0 109.81 -179.758 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 78.4 m-20 . . . . . 0 C--O 1.251 1.133 0 C-N-CA 125.334 1.454 . . . . 0.0 109.669 -180.0 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 1' ' ' SER . . . . . . . . . . . . . 6.2 p . . . . . 0 N--CA 1.466 0.368 0 N-CA-C 108.149 -1.056 . . . . 0.0 108.149 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 2' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -63.4 -22.0 66.62 Favored 'General case' 0 C--N 1.324 -0.534 0 C-N-CA 128.496 2.719 . . . . 0.0 111.508 -179.496 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 3' ' ' SER . . . . . . . . . . . . . 18.4 p -153.33 -177.54 6.4 Favored 'General case' 0 C--O 1.24 0.553 0 C-N-CA 125.701 1.6 . . . . 0.0 108.988 179.699 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 4' ' ' ALA . . . . . . . . . . . . . . . -128.19 161.4 29.39 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 126.443 1.897 . . . . 0.0 107.668 179.285 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 7.2 p -126.99 104.31 12.39 Favored 'Isoleucine or valine' 0 C--O 1.238 0.456 0 CA-C-O 122.043 0.925 . . . . 0.0 111.08 -178.797 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 6' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -92.66 143.5 26.25 Favored 'General case' 0 N--CA 1.463 0.219 0 C-N-CA 124.142 0.977 . . . . 0.0 108.392 179.056 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -160.62 160.38 31.61 Favored 'General case' 0 N--CA 1.467 0.393 0 C-N-CA 124.131 0.973 . . . . 0.0 110.702 179.676 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 24.4 mtpt 30.54 50.57 0.09 Allowed 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 129.566 3.146 . . . . 0.0 113.525 179.197 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 8.3 t -60.66 -70.67 0.16 Allowed 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 123.956 0.902 . . . . 0.0 111.851 -178.794 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 10' ' ' GLU . . . . . . . . . . . . . 5.1 tp10 -149.49 163.02 38.96 Favored 'General case' 0 C--O 1.235 0.3 0 O-C-N 121.093 -1.005 . . . . 0.0 109.177 -179.423 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 11' ' ' VAL . . . . . . . . . . . . . 13.7 t -139.83 94.37 0.77 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.27 0 N-CA-C 104.324 -2.473 . . . . 0.0 104.324 178.451 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 12' ' ' ARG . . . . . . . . . . . . . 37.4 ttm180 -141.68 166.0 25.95 Favored 'General case' 0 C--O 1.236 0.393 0 N-CA-C 108.068 -1.086 . . . . 0.0 108.068 -179.343 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 13' ' ' GLN . . . . . . . . . . . . . 16.2 mp0 -78.61 65.78 3.96 Favored 'General case' 0 C--O 1.234 0.27 0 N-CA-C 107.551 -1.277 . . . . 0.0 107.551 179.303 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 37.2 pttt -60.32 -38.79 84.83 Favored 'General case' 0 N--CA 1.452 -0.364 0 C-N-CA 124.767 1.227 . . . . 0.0 109.035 179.872 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 6.4 t -68.88 164.71 21.45 Favored 'General case' 0 N--CA 1.44 -0.967 0 CA-C-O 123.237 1.494 . . . . 0.0 109.885 178.363 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 36.4 t -102.42 146.53 10.31 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.873 0 N-CA-C 101.964 -3.347 . . . . 0.0 101.964 175.004 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 9.5 p -148.14 100.0 0.37 Allowed 'Isoleucine or valine' 0 N--CA 1.442 -0.861 0 N-CA-C 102.51 -3.144 . . . . 0.0 102.51 177.254 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 46.3 ttm-85 -142.34 160.51 40.11 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.057 -0.974 . . . . 0.0 109.282 -178.77 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -108.85 122.64 47.62 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 101.278 -3.601 . . . . 0.0 101.278 178.396 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 20' ' ' LEU . . . . . 0.44 HD11 ' HA ' ' A' ' 42' ' ' SER . 7.5 tt -134.44 112.62 11.08 Favored 'General case' 0 N--CA 1.463 0.208 0 C-N-CA 124.609 1.163 . . . . 0.0 109.199 -177.02 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 75.1 mtm-85 -78.98 162.45 25.95 Favored 'General case' 0 N--CA 1.47 0.562 0 N-CA-C 113.52 0.933 . . . . 0.0 113.52 -178.763 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 22' ' ' PHE . . . . . . . . . . . . . 45.4 m-85 -143.05 160.75 39.78 Favored 'General case' 0 N--CA 1.47 0.549 0 C-N-CA 127.117 2.167 . . . . 0.0 107.388 179.361 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 23' ' ' SER . . . . . 0.473 ' HB3' ' HD2' ' B' ' 24' ' ' PRO . 3.1 m -88.97 173.91 5.57 Favored Pre-proline 0 CA--C 1.545 0.756 0 C-N-CA 124.692 1.197 . . . . 0.0 109.899 179.823 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 24' ' ' PRO . . . . . 0.473 ' HD2' ' HB3' ' B' ' 23' ' ' SER . 55.7 Cg_endo -68.1 -47.47 1.72 Allowed 'Trans proline' 0 C--N 1.352 0.757 0 C-N-CA 121.687 1.591 . . . . 0.0 112.17 -178.543 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 25' ' ' VAL . . . . . . . . . . . . . 33.8 t -67.51 -31.23 51.76 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.388 0 C-N-CA 123.913 0.885 . . . . 0.0 110.296 -179.583 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 58.1 mt-10 -70.08 -48.7 56.66 Favored 'General case' 0 CA--C 1.529 0.137 0 N-CA-C 108.012 -1.107 . . . . 0.0 108.012 179.409 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 27' ' ' ASP . . . . . . . . . . . . . 23.8 t70 -60.38 -43.67 96.37 Favored 'General case' 0 C--O 1.219 -0.545 0 C-N-CA 124.968 1.307 . . . . 0.0 110.717 179.37 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 28' ' ' GLU . . . . . . . . . . . . . 12.9 tt0 -56.43 -52.2 65.54 Favored 'General case' 0 N--CA 1.454 -0.254 0 C-N-CA 124.768 1.227 . . . . 0.0 110.146 -179.696 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 4.1 m -56.71 -55.48 33.62 Favored 'General case' 0 CA--C 1.53 0.199 0 N-CA-C 109.118 -0.697 . . . . 0.0 109.118 178.96 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 73.2 mt -54.12 -50.92 51.58 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.202 0 C-N-CA 123.279 0.631 . . . . 0.0 110.845 -178.986 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 58.9 ttt180 -56.89 -48.31 78.47 Favored 'General case' 0 N--CA 1.449 -0.507 0 C-N-CA 124.587 1.155 . . . . 0.0 111.331 -178.952 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 1.9 mptm? -65.65 -45.98 80.93 Favored 'General case' 0 CA--C 1.515 -0.398 0 O-C-N 123.909 0.756 . . . . 0.0 110.379 -179.519 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 34.9 mmtt -62.47 -44.6 96.0 Favored 'General case' 0 C--N 1.333 -0.117 0 CA-C-N 119.455 1.025 . . . . 0.0 110.239 -179.02 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 34' ' ' ALA . . . . . . . . . . . . . . . -58.2 -54.61 45.05 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 124.866 1.267 . . . . 0.0 110.024 179.192 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 7.4 tp10 -66.57 -16.78 64.41 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 124.635 1.174 . . . . 0.0 112.775 -179.055 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 36' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -102.05 4.61 39.95 Favored 'General case' 0 C--N 1.327 -0.409 0 C-N-CA 126.015 1.726 . . . . 0.0 111.466 -179.899 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 37' ' ' SER . . . . . . . . . . . . . 9.1 t -127.59 -1.27 6.15 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 124.424 1.09 . . . . 0.0 112.094 179.825 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 67.79 28.72 73.45 Favored Glycine 0 CA--C 1.529 0.936 0 CA-C-N 119.876 1.216 . . . . 0.0 110.64 -178.892 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 39' ' ' LEU . . . . . . . . . . . . . 90.0 mt -120.1 125.24 47.79 Favored 'General case' 0 N--CA 1.444 -0.725 0 C-N-CA 126.041 1.736 . . . . 0.0 106.94 -179.061 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 40' ' ' THR . . . . . 0.543 HG23 ' H ' ' B' ' 43' ' ' ALA . 1.8 t -63.8 153.83 35.33 Favored 'General case' 0 CA--C 1.538 0.502 0 N-CA-C 104.703 -2.332 . . . . 0.0 104.703 176.8 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 41' ' ' VAL . . . . . . . . . . . . . 55.1 t -48.64 -38.75 10.01 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.498 0 O-C-N 121.392 -0.818 . . . . 0.0 110.261 179.071 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 42' ' ' SER . . . . . . . . . . . . . 14.4 m -62.39 -46.55 88.09 Favored 'General case' 0 CA--C 1.533 0.324 0 O-C-N 121.057 -1.027 . . . . 0.0 111.368 179.085 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 43' ' ' ALA . . . . . 0.543 ' H ' HG23 ' B' ' 40' ' ' THR . . . -64.9 -40.91 95.83 Favored 'General case' 0 C--N 1.34 0.164 0 C-N-CA 123.913 0.885 . . . . 0.0 109.23 178.803 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 44' ' ' TYR . . . . . . . . . . . . . 57.3 t80 -58.45 -50.92 71.99 Favored 'General case' 0 CA--C 1.539 0.54 0 N-CA-C 108.276 -1.009 . . . . 0.0 108.276 179.106 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 45' ' ' ILE . . . . . . . . . . . . . 12.9 mm -56.74 -61.32 1.26 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.301 0 C-N-CA 125.122 1.369 . . . . 0.0 108.609 178.807 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 46' ' ' ARG . . . . . . . . . . . . . 40.2 mtp180 -43.9 -66.01 0.43 Allowed 'General case' 0 C--O 1.219 -0.51 0 C-N-CA 126.044 1.738 . . . . 0.0 110.588 179.781 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 47' ' ' ASN . . . . . . . . . . . . . 20.5 t30 -53.25 -49.54 66.67 Favored 'General case' 0 N--CA 1.441 -0.88 0 C-N-CA 124.719 1.208 . . . . 0.0 113.601 -178.04 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -63.18 -31.62 72.81 Favored 'General case' 0 CA--C 1.535 0.399 0 CA-C-N 118.99 0.814 . . . . 0.0 111.264 179.514 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 49' ' ' ALA . . . . . . . . . . . . . . . -78.68 -16.09 57.7 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 124.067 0.947 . . . . 0.0 113.512 -179.712 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 13.9 mt -100.32 -38.02 8.63 Favored 'General case' 0 C--O 1.234 0.283 0 O-C-N 121.451 -0.781 . . . . 0.0 109.981 179.886 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 51' ' ' ASN . . . . . . . . . . . . . 43.2 m-80 . . . . . 0 C--O 1.246 0.907 0 C-N-CA 124.502 1.121 . . . . 0.0 110.136 179.155 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 5.2 t . . . . . 0 N--CA 1.471 0.589 0 N-CA-C 105.85 -1.907 . . . . 0.0 105.85 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -141.89 139.24 32.53 Favored 'General case' 0 C--O 1.236 0.37 0 CA-C-N 118.826 0.739 . . . . 0.0 109.721 -177.808 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 20.1 m -73.73 162.73 28.84 Favored 'General case' 0 CA--C 1.535 0.397 0 N-CA-C 108.736 -0.838 . . . . 0.0 108.736 178.978 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -126.58 -18.51 4.79 Favored 'General case' 0 C--O 1.235 0.339 0 N-CA-C 113.212 0.819 . . . . 0.0 113.212 -179.896 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 9.6 m -157.26 170.75 0.55 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.417 0 C-N-CA 128.231 2.613 . . . . 0.0 106.819 178.959 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 91.1 mtt180 -140.02 -75.84 0.34 Allowed 'General case' 0 N--CA 1.464 0.26 0 C-N-CA 123.321 0.649 . . . . 0.0 109.411 178.499 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 36.5 mtmt -121.53 155.84 34.12 Favored 'General case' 0 C--O 1.235 0.335 0 C-N-CA 124.324 1.05 . . . . 0.0 109.136 -179.595 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 95.4 mttt -132.79 167.83 19.45 Favored 'General case' 0 C--O 1.236 0.376 0 C-N-CA 124.957 1.303 . . . . 0.0 109.758 -179.566 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 31.7 p -152.07 173.01 15.42 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 108.893 -0.78 . . . . 0.0 108.893 178.999 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 22.8 tt0 -120.08 6.2 10.81 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 125.056 1.343 . . . . 0.0 110.49 179.64 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 9.8 p -113.9 5.34 7.82 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.66 0 C-N-CA 126.64 1.976 . . . . 0.0 110.643 179.793 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 13.6 tpt180 -128.27 105.9 8.66 Favored 'General case' 0 CA--C 1.515 -0.4 0 N-CA-C 107.105 -1.443 . . . . 0.0 107.105 179.81 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 6.6 pt20 -71.69 105.74 3.82 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 105.318 -2.104 . . . . 0.0 105.318 178.147 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . 0.41 ' H ' ' CE ' ' A' ' 14' ' ' LYS . 0.0 OUTLIER -59.19 -27.67 65.92 Favored 'General case' 0 N--CA 1.465 0.311 0 C-N-CA 122.819 0.448 . . . . 0.0 111.285 179.618 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 12.2 t -76.51 -176.86 3.89 Favored 'General case' 0 N--CA 1.436 -1.159 0 CA-C-O 124.107 1.908 . . . . 0.0 110.89 178.966 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 16.1 t -122.92 144.19 33.26 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.961 1 N-CA-C 100.072 -4.047 . . . . 0.0 100.072 176.51 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 13.1 p -136.9 102.08 2.57 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.021 0 N-CA-C 104.244 -2.502 . . . . 0.0 104.244 179.234 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 6.0 mtt-85 -128.25 158.96 36.7 Favored 'General case' 0 CA--C 1.509 -0.603 0 CA-C-O 123.103 1.43 . . . . 0.0 109.792 -179.969 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 3.7 m -94.2 83.21 4.21 Favored 'General case' 0 N--CA 1.439 -1.003 0 N-CA-C 104.049 -2.574 . . . . 0.0 104.049 -179.234 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -84.17 92.67 7.98 Favored 'General case' 0 C--N 1.325 -0.458 0 C-N-CA 124.294 1.037 . . . . 0.0 111.058 -177.771 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -74.2 146.48 43.34 Favored 'General case' 0 N--CA 1.447 -0.596 0 C-N-CA 123.961 0.904 . . . . 0.0 112.666 179.204 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 90.5 m-85 -137.11 152.29 49.83 Favored 'General case' 0 C--O 1.238 0.458 0 C-N-CA 126.624 1.97 . . . . 0.0 106.088 177.274 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 1.2 m -86.52 167.68 21.82 Favored Pre-proline 0 CA--C 1.543 0.692 0 N-CA-C 106.59 -1.633 . . . . 0.0 106.59 179.438 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -66.76 -30.84 40.73 Favored 'Trans proline' 0 CA--C 1.531 0.368 0 CA-C-N 121.201 1.465 . . . . 0.0 111.428 -179.355 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 44.8 t -69.32 -45.29 79.35 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.322 0 N-CA-C 108.456 -0.942 . . . . 0.0 108.456 179.308 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -64.37 -46.24 84.26 Favored 'General case' 0 C--O 1.224 -0.276 0 N-CA-C 109.52 -0.548 . . . . 0.0 109.52 -179.789 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -58.35 -44.21 88.66 Favored 'General case' 0 CA--C 1.513 -0.458 0 C-N-CA 123.874 0.87 . . . . 0.0 111.233 -179.772 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 15.3 tm-20 -62.24 -51.39 67.95 Favored 'General case' 0 N--CA 1.448 -0.565 0 N-CA-C 109.166 -0.679 . . . . 0.0 109.166 179.856 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 88.9 m -59.38 -53.41 58.56 Favored 'General case' 0 CA--C 1.534 0.34 0 CA-C-N 118.353 0.524 . . . . 0.0 110.009 179.482 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 83.9 mt -57.97 -43.53 85.0 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.293 0 C-N-CA 124.193 0.997 . . . . 0.0 109.861 -179.283 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 40.8 ttt180 -62.94 -42.23 99.74 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-N 119.296 0.953 . . . . 0.0 110.16 -179.63 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 4.7 mptp? -68.98 -47.71 64.91 Favored 'General case' 0 CA--C 1.515 -0.38 0 CA-C-O 118.843 -0.598 . . . . 0.0 109.864 -179.554 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 21.3 tptt -63.01 -41.1 99.48 Favored 'General case' 0 C--O 1.224 -0.27 0 CA-C-O 119.005 -0.521 . . . . 0.0 110.536 -179.488 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -61.08 -53.45 57.0 Favored 'General case' 0 N--CA 1.453 -0.294 0 C-N-CA 124.841 1.257 . . . . 0.0 109.236 179.071 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 30.5 tt0 -57.84 -44.23 86.38 Favored 'General case' 0 N--CA 1.453 -0.303 0 C-N-CA 122.966 0.507 . . . . 0.0 111.17 -179.299 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 27.0 t0 -67.33 -39.61 85.86 Favored 'General case' 0 C--N 1.332 -0.156 0 C-N-CA 123.378 0.671 . . . . 0.0 109.9 -179.85 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 22.9 t -72.3 -9.17 58.14 Favored 'General case' 0 N--CA 1.451 -0.403 0 C-N-CA 124.53 1.132 . . . . 0.0 111.007 179.66 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 65.49 29.76 75.95 Favored Glycine 0 CA--C 1.53 1.012 0 CA-C-N 119.391 0.996 . . . . 0.0 111.683 -179.682 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 71.6 mt -133.42 115.65 15.09 Favored 'General case' 0 N--CA 1.451 -0.42 0 N-CA-C 103.797 -2.668 . . . . 0.0 103.797 179.703 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 14.8 t -57.13 161.65 3.01 Favored 'General case' 0 CA--C 1.535 0.391 0 CA-C-N 119.276 0.944 . . . . 0.0 110.19 -179.843 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 97.7 t -44.19 -45.77 2.24 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.213 0 C-N-CA 126.118 1.767 . . . . 0.0 111.555 -178.812 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 2.5 p -64.19 -47.49 79.58 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-N 120.304 1.411 . . . . 0.0 112.076 -179.806 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -62.1 -44.28 97.0 Favored 'General case' 0 C--O 1.222 -0.353 0 C-N-CA 124.412 1.085 . . . . 0.0 109.176 178.69 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 61.2 t80 -59.27 -51.07 71.55 Favored 'General case' 0 N--CA 1.453 -0.322 0 C-N-CA 125.403 1.481 . . . . 0.0 108.798 179.073 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.411 HG23 HG23 ' B' ' 45' ' ' ILE . 13.8 mm -55.19 -60.32 1.73 Allowed 'Isoleucine or valine' 0 C--O 1.226 -0.132 0 C-N-CA 124.408 1.083 . . . . 0.0 110.163 179.705 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 21.2 ptt180 -59.93 -44.64 94.21 Favored 'General case' 0 C--O 1.219 -0.524 0 CA-C-O 118.366 -0.826 . . . . 0.0 110.499 -179.2 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 18.0 t30 -53.57 -56.73 14.6 Favored 'General case' 0 CA--C 1.519 -0.215 0 CA-C-N 119.374 0.988 . . . . 0.0 110.079 179.875 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -61.42 -33.13 73.19 Favored 'General case' 0 N--CA 1.453 -0.284 0 C-N-CA 124.174 0.99 . . . . 0.0 112.245 -179.81 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -75.5 -24.42 56.85 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 123.441 0.696 . . . . 0.0 112.874 -179.588 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 11.8 mt -98.55 -29.19 13.22 Favored 'General case' 0 N--CA 1.465 0.298 0 C-N-CA 123.583 0.753 . . . . 0.0 111.325 -179.399 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 43.3 m-80 . . . . . 0 C--O 1.243 0.75 0 C-N-CA 126.655 1.982 . . . . 0.0 108.378 -179.846 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 1' ' ' SER . . . . . . . . . . . . . 6.8 t . . . . . 0 CA--C 1.509 -0.612 0 N-CA-C 103.039 -2.948 . . . . 0.0 103.039 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 2' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -140.58 160.95 38.89 Favored 'General case' 0 C--O 1.235 0.34 0 O-C-N 123.418 0.449 . . . . 0.0 110.938 -176.428 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 3' ' ' SER . . . . . . . . . . . . . 17.4 m -110.98 154.79 23.64 Favored 'General case' 0 C--O 1.236 0.38 0 C-N-CA 125.184 1.394 . . . . 0.0 109.308 179.245 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 4' ' ' ALA . . . . . . . . . . . . . . . -133.37 -44.96 0.83 Allowed 'General case' 0 C--O 1.235 0.291 0 C-N-CA 125.297 1.439 . . . . 0.0 109.012 179.5 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 9.7 p -136.12 152.52 30.39 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.315 0 C-N-CA 126.006 1.722 . . . . 0.0 108.553 179.729 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 6' ' ' ARG . . . . . . . . . . . . . 80.3 mtt180 -132.26 -68.84 0.61 Allowed 'General case' 0 C--N 1.332 -0.154 0 N-CA-C 106.119 -1.808 . . . . 0.0 106.119 179.01 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 19.8 pttt -129.4 176.4 7.99 Favored 'General case' 0 C--O 1.235 0.313 0 C-N-CA 124.111 0.965 . . . . 0.0 110.097 179.411 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 17.9 pttt -143.34 -177.44 5.38 Favored 'General case' 0 C--O 1.236 0.385 0 C-N-CA 126.057 1.743 . . . . 0.0 109.5 -179.884 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 6.2 p -160.93 174.73 13.38 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 126.248 1.819 . . . . 0.0 110.151 -178.564 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 10' ' ' GLU . . . . . . . . . . . . . 15.6 tt0 -141.18 2.29 1.69 Allowed 'General case' 0 N--CA 1.469 0.501 0 N-CA-C 115.203 1.557 . . . . 0.0 115.203 -179.618 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 11' ' ' VAL . . . . . . . . . . . . . 14.3 m -116.02 31.43 1.8 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 C-N-CA 125.045 1.338 . . . . 0.0 109.815 179.504 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 12' ' ' ARG . . . . . . . . . . . . . 2.7 tpt180 -151.29 147.93 27.56 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 128.415 2.686 . . . . 0.0 105.095 -179.609 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 13' ' ' GLN . . . . . . . . . . . . . 82.8 mt-30 -116.74 102.77 9.71 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-N 119.851 1.205 . . . . 0.0 109.1 -179.206 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 8.2 ptmt -69.27 -32.17 71.17 Favored 'General case' 0 N--CA 1.464 0.242 0 C-N-CA 123.238 0.615 . . . . 0.0 110.65 179.956 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 4.5 t -72.11 165.49 24.22 Favored 'General case' 0 N--CA 1.442 -0.841 0 N-CA-C 108.852 -0.796 . . . . 0.0 108.852 178.536 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 21.4 t -105.56 120.28 56.1 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.53 0 N-CA-C 104.58 -2.378 . . . . 0.0 104.58 178.674 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 9.4 p -115.59 90.7 1.58 Allowed 'Isoleucine or valine' 0 N--CA 1.447 -0.6 0 N-CA-C 106.233 -1.766 . . . . 0.0 106.233 178.717 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -117.77 161.64 19.37 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 114.234 -1.348 . . . . 0.0 109.185 -179.857 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 56.3 m -104.99 88.68 2.93 Favored 'General case' 0 N--CA 1.448 -0.526 0 N-CA-C 105.155 -2.165 . . . . 0.0 105.155 -179.654 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -90.7 105.6 17.94 Favored 'General case' 0 C--N 1.324 -0.514 0 C-N-CA 125.612 1.565 . . . . 0.0 110.894 -178.47 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 1.4 mpp_? -82.55 154.07 25.21 Favored 'General case' 0 N--CA 1.455 -0.216 0 C-N-CA 123.548 0.739 . . . . 0.0 111.555 178.847 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 22' ' ' PHE . . . . . . . . . . . . . 81.7 m-85 -138.35 141.69 39.7 Favored 'General case' 0 CA--C 1.516 -0.342 0 N-CA-C 106.624 -1.621 . . . . 0.0 106.624 178.129 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 14.5 m -71.61 165.76 46.12 Favored Pre-proline 0 CA--C 1.539 0.556 0 N-CA-C 109.318 -0.623 . . . . 0.0 109.318 179.653 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 24' ' ' PRO . . . . . . . . . . . . . 33.9 Cg_endo -62.36 -38.52 53.04 Favored 'Trans proline' 0 C--N 1.348 0.529 0 C-N-CA 121.457 1.438 . . . . 0.0 111.145 -179.4 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 25' ' ' VAL . . . . . . . . . . . . . 60.5 t -65.42 -49.39 78.71 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.254 0 C-N-CA 124.433 1.093 . . . . 0.0 109.346 179.41 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 54.8 mt-10 -58.96 -49.33 78.26 Favored 'General case' 0 C--O 1.223 -0.335 0 C-N-CA 124.097 0.959 . . . . 0.0 109.743 -179.716 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 27' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -59.83 -39.04 83.73 Favored 'General case' 0 N--CA 1.453 -0.306 0 C-N-CA 124.753 1.221 . . . . 0.0 111.771 -179.832 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 28' ' ' GLU . . . . . . . . . . . . . 12.4 tt0 -66.61 -53.33 35.44 Favored 'General case' 0 N--CA 1.453 -0.315 0 N-CA-C 109.231 -0.655 . . . . 0.0 109.231 179.551 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 64.8 m -57.63 -50.58 72.67 Favored 'General case' 0 N--CA 1.454 -0.251 0 C-N-CA 124.064 0.945 . . . . 0.0 110.02 179.438 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 81.3 mt -60.78 -42.93 94.12 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.354 0 C-N-CA 123.564 0.746 . . . . 0.0 109.275 -179.676 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 56.8 ttt180 -61.42 -51.01 70.52 Favored 'General case' 0 CA--C 1.519 -0.213 0 CA-C-N 119.296 0.953 . . . . 0.0 110.211 179.261 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 5.0 mptp? -60.77 -44.16 97.11 Favored 'General case' 0 CA--C 1.52 -0.195 0 CA-C-N 118.371 0.532 . . . . 0.0 110.388 -179.293 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 34.4 tptt -68.81 -38.99 80.29 Favored 'General case' 0 CA--C 1.528 0.129 0 CA-C-N 118.865 0.757 . . . . 0.0 111.088 -179.631 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 34' ' ' ALA . . . . . . . . . . . . . . . -65.81 -36.25 82.97 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-O 122.577 1.18 . . . . 0.0 109.348 178.825 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 20.6 tt0 -75.7 -19.39 59.14 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 124.137 0.975 . . . . 0.0 110.294 179.433 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 36' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -86.19 -45.55 11.22 Favored 'General case' 0 C--O 1.232 0.169 0 C-N-CA 125.561 1.544 . . . . 0.0 109.856 179.109 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 37' ' ' SER . . . . . . . . . . . . . 48.0 t -79.16 -10.96 59.96 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-O 118.787 -0.625 . . . . 0.0 109.914 -179.911 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 82.39 -7.69 63.75 Favored Glycine 0 C--N 1.338 0.685 0 C-N-CA 124.975 1.274 . . . . 0.0 115.165 178.227 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 39' ' ' LEU . . . . . . . . . . . . . 13.8 mt -96.44 125.48 40.96 Favored 'General case' 0 CA--C 1.518 -0.253 0 CA-C-N 120.235 2.017 . . . . 0.0 105.85 -179.519 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 40' ' ' THR . . . . . . . . . . . . . 5.3 t -45.85 151.32 0.46 Allowed 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 125.202 1.401 . . . . 0.0 110.497 179.851 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 41' ' ' VAL . . . . . . . . . . . . . 53.3 t -45.73 -46.41 4.93 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.218 0 C-N-CA 125.307 1.443 . . . . 0.0 111.772 -179.047 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 42' ' ' SER . . . . . . . . . . . . . 9.6 p -55.55 -45.38 77.27 Favored 'General case' 0 C--O 1.235 0.291 0 O-C-N 121.747 -0.596 . . . . 0.0 112.188 -179.967 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -70.23 -46.74 63.86 Favored 'General case' 0 C--O 1.222 -0.391 0 C-N-CA 124.582 1.153 . . . . 0.0 108.854 178.936 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 44' ' ' TYR . . . . . . . . . . . . . 38.8 t80 -49.61 -50.58 42.23 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 124.626 1.17 . . . . 0.0 109.08 179.662 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 45' ' ' ILE . . . . . 0.411 HG23 HG23 ' A' ' 45' ' ' ILE . 21.6 mm -54.44 -61.19 1.04 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.421 0 C-N-CA 124.085 0.954 . . . . 0.0 111.395 179.457 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 46' ' ' ARG . . . . . . . . . . . . . 12.1 ptm180 -59.91 -43.97 94.56 Favored 'General case' 0 N--CA 1.467 0.396 0 O-C-N 121.736 -0.602 . . . . 0.0 111.704 -178.766 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 47' ' ' ASN . . . . . . . . . . . . . 20.6 t30 -56.95 -57.16 13.73 Favored 'General case' 0 N--CA 1.449 -0.509 0 C-N-CA 124.392 1.077 . . . . 0.0 110.76 -179.113 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -61.95 -33.41 74.23 Favored 'General case' 0 N--CA 1.453 -0.281 0 C-N-CA 124.404 1.081 . . . . 0.0 111.708 -179.968 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 49' ' ' ALA . . . . . . . . . . . . . . . -68.56 -42.24 78.64 Favored 'General case' 0 N--CA 1.451 -0.376 0 O-C-N 121.703 -0.623 . . . . 0.0 112.114 -179.11 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 12.5 mt -80.46 -36.03 34.08 Favored 'General case' 0 C--N 1.328 -0.362 0 C-N-CA 123.115 0.566 . . . . 0.0 112.061 -178.844 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 51' ' ' ASN . . . . . . . . . . . . . 46.7 m-80 . . . . . 0 C--O 1.248 1.0 0 CA-C-O 117.362 -1.304 . . . . 0.0 109.769 -179.077 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 15.0 m . . . . . 0 N--CA 1.481 1.09 0 N-CA-C 108.476 -0.935 . . . . 0.0 108.476 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 3.9 p-10 -18.07 -70.55 0.01 OUTLIER 'General case' 0 CA--C 1.537 0.468 1 C-N-CA 134.062 4.945 . . . . 0.0 113.998 176.369 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 68.1 m -63.1 26.39 0.01 OUTLIER 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 131.671 3.989 . . . . 0.0 116.125 -178.71 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -48.46 -29.75 4.43 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 125.086 1.354 . . . . 0.0 112.477 179.693 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 19.1 m -50.28 -40.32 17.72 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.492 0 CA-C-N 120.152 1.342 . . . . 0.0 112.178 178.674 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 82.0 mtt85 -61.59 -3.61 1.1 Allowed 'General case' 0 N--CA 1.463 0.218 0 N-CA-C 115.745 1.757 . . . . 0.0 115.745 -178.07 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -118.58 -3.18 10.89 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 120.182 1.355 . . . . 0.0 112.587 178.426 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 6.2 ttpp 175.24 108.27 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.24 0 C-N-CA 127.352 2.261 . . . . 0.0 106.435 179.857 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 15.9 p -151.59 170.1 20.5 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 118.862 0.755 . . . . 0.0 108.998 179.181 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.3 pm0 -96.68 160.62 14.28 Favored 'General case' 0 C--O 1.239 0.502 0 N-CA-C 106.417 -1.698 . . . . 0.0 106.417 177.803 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 14.9 p -112.31 110.25 31.52 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.614 0 CA-C-O 121.682 0.753 . . . . 0.0 109.168 179.832 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 27.3 ptt85 -58.49 110.83 1.05 Allowed 'General case' 0 C--O 1.236 0.388 0 C-N-CA 126.774 2.03 . . . . 0.0 107.155 178.737 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 33.1 mt-30 -77.6 85.14 3.95 Favored 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 123.76 0.824 . . . . 0.0 110.02 -179.148 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 46.0 pttt -66.08 -14.73 62.24 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 123.395 0.678 . . . . 0.0 111.624 178.257 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 14.6 t -74.68 179.47 4.75 Favored 'General case' 0 N--CA 1.446 -0.674 0 N-CA-C 107.048 -1.464 . . . . 0.0 107.048 177.718 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 36.2 t -119.56 129.31 75.49 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.672 0 N-CA-C 104.108 -2.553 . . . . 0.0 104.108 178.92 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 14.3 p -122.0 98.97 6.35 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.515 0 N-CA-C 102.842 -3.021 . . . . 0.0 102.842 178.202 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 62.4 mtt-85 -140.42 164.9 28.88 Favored 'General case' 0 CA--C 1.51 -0.565 0 CA-C-N 115.021 -0.99 . . . . 0.0 110.119 -179.279 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -110.39 148.76 31.37 Favored 'General case' 0 N--CA 1.444 -0.73 0 C-N-CA 125.216 1.406 . . . . 0.0 107.615 179.272 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 58.2 mt -145.09 112.87 6.33 Favored 'General case' 0 CA--C 1.51 -0.558 0 N-CA-C 107.228 -1.397 . . . . 0.0 107.228 178.749 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 14.8 mtm180 -86.42 152.17 22.92 Favored 'General case' 0 C--O 1.238 0.492 0 N-CA-C 107.416 -1.327 . . . . 0.0 107.416 178.052 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 87.7 m-85 -132.8 140.08 47.83 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 105.415 -2.069 . . . . 0.0 105.415 179.58 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -66.76 173.15 2.66 Favored Pre-proline 0 CA--C 1.552 1.037 0 CA-C-N 119.324 0.965 . . . . 0.0 109.53 -179.841 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 28.9 Cg_endo -63.44 -42.29 22.42 Favored 'Trans proline' 0 C--N 1.348 0.517 0 C-N-CA 121.845 1.697 . . . . 0.0 112.983 -178.029 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 38.4 t -67.11 -40.05 84.51 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.306 0 C-N-CA 123.613 0.765 . . . . 0.0 109.653 -179.995 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 -66.26 -44.18 84.35 Favored 'General case' 0 CA--C 1.521 -0.171 0 C-N-CA 124.94 1.296 . . . . 0.0 111.089 -178.791 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 34.5 t70 -61.88 -49.11 77.54 Favored 'General case' 0 CA--C 1.502 -0.89 0 N-CA-C 108.289 -1.004 . . . . 0.0 108.289 179.22 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 44.8 tt0 -52.52 -43.77 65.33 Favored 'General case' 0 N--CA 1.445 -0.714 0 CA-C-O 118.325 -0.845 . . . . 0.0 110.941 179.945 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 32.4 m -65.92 -54.92 20.15 Favored 'General case' 0 CA--C 1.529 0.154 0 CA-C-N 118.837 0.744 . . . . 0.0 109.631 179.185 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 79.9 mt -63.11 -25.6 38.92 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.325 0 CA-C-O 121.724 0.773 . . . . 0.0 111.784 -178.661 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 42.2 ttt180 -77.84 -45.46 24.26 Favored 'General case' 0 C--N 1.316 -0.882 0 O-C-N 119.826 -1.796 . . . . 0.0 107.582 179.526 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 5.6 mptt -68.47 -47.28 67.53 Favored 'General case' 0 CA--C 1.519 -0.22 0 CA-C-O 118.167 -0.92 . . . . 0.0 112.78 179.879 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 29.3 tptt -67.97 -33.67 75.09 Favored 'General case' 0 CA--C 1.523 -0.081 0 CA-C-N 120.407 1.458 . . . . 0.0 111.746 -177.941 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -67.13 -54.88 17.17 Favored 'General case' 0 C--N 1.331 -0.207 0 C-N-CA 125.249 1.42 . . . . 0.0 108.212 179.599 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 22.7 tt0 -60.13 -39.99 88.22 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-N 115.48 -0.782 . . . . 0.0 111.213 -179.143 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -64.95 -41.25 95.66 Favored 'General case' 0 N--CA 1.462 0.126 0 C-N-CA 124.857 1.263 . . . . 0.0 109.984 179.111 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 35.7 m -79.57 -9.05 59.56 Favored 'General case' 0 N--CA 1.448 -0.574 0 C-N-CA 123.741 0.817 . . . . 0.0 112.706 -179.388 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 75.15 13.56 82.63 Favored Glycine 0 CA--C 1.531 1.045 0 CA-C-N 119.377 0.99 . . . . 0.0 113.508 -179.972 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 13.0 mt -115.77 116.43 28.03 Favored 'General case' 0 CA--C 1.511 -0.549 0 N-CA-C 104.379 -2.452 . . . . 0.0 104.379 179.047 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 9.9 t -53.47 157.39 2.11 Favored 'General case' 0 CA--C 1.537 0.449 0 N-CA-C 109.486 -0.561 . . . . 0.0 109.486 179.062 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 61.0 t -45.62 -43.86 4.08 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.206 0 C-N-CA 125.223 1.409 . . . . 0.0 111.551 -179.457 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 97.7 p -59.68 -50.36 74.16 Favored 'General case' 0 CA--C 1.545 0.752 0 CA-C-N 119.44 1.018 . . . . 0.0 111.206 -179.42 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.5 -42.55 98.5 Favored 'General case' 0 C--N 1.339 0.126 0 C-N-CA 124.302 1.041 . . . . 0.0 109.743 179.161 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 67.9 t80 -57.46 -53.33 59.42 Favored 'General case' 0 N--CA 1.45 -0.467 0 N-CA-C 109.335 -0.617 . . . . 0.0 109.335 179.211 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 23.3 mm -54.13 -54.83 17.84 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.152 0 C-N-CA 124.269 1.027 . . . . 0.0 111.372 -179.292 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 13.2 ptt180 -60.78 -50.84 71.83 Favored 'General case' 0 N--CA 1.464 0.266 0 O-C-N 121.609 -0.682 . . . . 0.0 111.397 -179.615 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 22.9 t30 -55.41 -58.37 8.04 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 118.667 -0.682 . . . . 0.0 110.463 -179.562 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -57.14 -31.97 65.89 Favored 'General case' 0 N--CA 1.456 -0.138 0 C-N-CA 124.106 0.963 . . . . 0.0 113.297 -178.934 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -79.81 -33.21 40.61 Favored 'General case' 0 CA--C 1.531 0.248 0 N-CA-C 114.396 1.258 . . . . 0.0 114.396 -179.18 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 13.8 mt -82.98 -33.42 26.62 Favored 'General case' 0 N--CA 1.47 0.53 0 CA-C-N 118.5 0.591 . . . . 0.0 111.316 -178.988 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 3.4 m-80 . . . . . 0 C--O 1.249 1.028 0 C-N-CA 124.646 1.179 . . . . 0.0 108.335 179.107 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 1' ' ' SER . . . . . . . . . . . . . 15.8 m . . . . . 0 N--CA 1.485 1.288 0 N-CA-C 113.402 0.89 . . . . 0.0 113.402 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 2' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -65.52 -177.02 0.39 Allowed 'General case' 0 C--N 1.323 -0.579 1 C-N-CA 136.417 5.887 . . . . 0.0 112.798 -178.302 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 3' ' ' SER . . . . . . . . . . . . . 24.1 m 60.75 10.12 2.52 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 125.744 1.618 . . . . 0.0 114.598 179.643 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 4' ' ' ALA . . . . . . . . . . . . . . . -52.68 -28.22 20.83 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 124.744 1.217 . . . . 0.0 112.408 -179.779 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 14.0 p -49.25 -32.04 5.36 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.567 0 C-N-CA 126.177 1.791 . . . . 0.0 112.537 178.957 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 6' ' ' ARG . . . . . . . . . . . . . 53.9 mtt85 -94.37 -30.83 14.29 Favored 'General case' 0 N--CA 1.47 0.551 0 CA-C-N 119.799 1.182 . . . . 0.0 110.68 178.763 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.81 -38.35 78.42 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-N 119.392 0.996 . . . . 0.0 108.932 179.244 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 18.2 ttmm -159.73 155.48 26.03 Favored 'General case' 0 N--CA 1.454 -0.275 0 N-CA-C 107.384 -1.339 . . . . 0.0 107.384 178.286 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 61.0 p 115.66 145.97 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.504 1 C-N-CA 132.504 4.322 . . . . 0.0 109.991 179.04 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 10' ' ' GLU . . . . . . . . . . . . . 1.6 pm0 -148.39 85.13 1.51 Allowed 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 125.358 1.463 . . . . 0.0 107.868 -179.156 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 11' ' ' VAL . . . . . . . . . . . . . 46.6 t -125.82 81.85 0.74 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.338 0 N-CA-C 108.129 -1.064 . . . . 0.0 108.129 -179.042 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 12' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -145.19 99.97 3.4 Favored 'General case' 0 C--O 1.235 0.324 0 C-N-CA 124.24 1.016 . . . . 0.0 108.301 179.846 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 13' ' ' GLN . . . . . . . . . . . . . 16.9 mt-30 -134.04 35.86 3.28 Favored 'General case' 0 N--CA 1.467 0.394 0 C-N-CA 123.487 0.715 . . . . 0.0 110.134 178.773 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 41.3 pttt -46.93 -24.03 0.54 Allowed 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 127.731 2.412 . . . . 0.0 114.142 179.439 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 12.4 t -75.27 -154.35 0.04 OUTLIER 'General case' 0 N--CA 1.441 -0.883 0 C-N-CA 126.392 1.877 . . . . 0.0 107.35 178.149 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 21.1 t -138.11 152.85 26.32 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.516 0 N-CA-C 106.762 -1.57 . . . . 0.0 106.762 -179.905 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 9.8 p -141.62 104.19 1.3 Allowed 'Isoleucine or valine' 0 N--CA 1.441 -0.891 0 N-CA-C 104.46 -2.422 . . . . 0.0 104.46 177.795 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 30.2 mtt-85 -149.66 152.98 36.28 Favored 'General case' 0 CA--C 1.517 -0.31 0 O-C-N 121.708 -0.62 . . . . 0.0 110.636 -179.323 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 2.3 m -100.36 145.13 28.54 Favored 'General case' 0 C--N 1.327 -0.412 0 C-N-CA 124.909 1.283 . . . . 0.0 108.584 -179.515 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 61.3 mt -134.79 112.84 11.05 Favored 'General case' 0 CA--C 1.52 -0.183 0 N-CA-C 107.699 -1.223 . . . . 0.0 107.699 178.871 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 21.8 mmm-85 -82.52 118.16 23.05 Favored 'General case' 0 C--O 1.233 0.234 0 C-N-CA 124.56 1.144 . . . . 0.0 108.747 179.706 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 22' ' ' PHE . . . . . . . . . . . . . 96.7 m-85 -113.55 155.71 24.92 Favored 'General case' 0 N--CA 1.475 0.808 0 CA-C-N 119.725 1.148 . . . . 0.0 108.421 179.427 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -85.91 168.17 20.75 Favored Pre-proline 0 CA--C 1.541 0.619 0 N-CA-C 107.607 -1.257 . . . . 0.0 107.607 179.509 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 24' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_endo -62.77 -33.21 77.08 Favored 'Trans proline' 0 N--CA 1.459 -0.504 0 C-N-CA 121.611 1.54 . . . . 0.0 112.868 -178.835 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 25' ' ' VAL . . . . . . . . . . . . . 26.3 t -68.25 -57.0 10.57 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.187 0 C-N-CA 124.154 0.982 . . . . 0.0 108.907 179.566 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 2.4 mp0 -55.29 -42.5 73.7 Favored 'General case' 0 CA--C 1.529 0.143 0 C-N-CA 123.568 0.747 . . . . 0.0 110.972 -179.703 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 27' ' ' ASP . . . . . . . . . . . . . 5.0 t70 -63.47 -44.66 93.79 Favored 'General case' 0 C--O 1.224 -0.282 0 C-N-CA 123.476 0.71 . . . . 0.0 109.956 178.776 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 28' ' ' GLU . . . . . . . . . . . . . 19.1 tt0 -58.5 -49.06 78.75 Favored 'General case' 0 N--CA 1.45 -0.464 0 N-CA-C 109.285 -0.635 . . . . 0.0 109.285 179.762 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 88.4 m -58.9 -54.68 44.34 Favored 'General case' 0 N--CA 1.452 -0.362 0 C-N-CA 124.835 1.254 . . . . 0.0 109.686 179.816 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 63.8 mt -59.59 -44.98 94.49 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.132 0 CA-C-N 118.302 0.501 . . . . 0.0 110.461 -179.54 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 77.0 ttt180 -59.08 -47.86 83.71 Favored 'General case' 0 C--O 1.235 0.32 0 C-N-CA 123.4 0.68 . . . . 0.0 110.75 -179.14 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 9.2 mptt -62.85 -50.44 70.93 Favored 'General case' 0 CA--C 1.512 -0.494 0 O-C-N 123.812 0.695 . . . . 0.0 109.621 179.27 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 9.1 tptt -62.23 -38.83 90.71 Favored 'General case' 0 CA--C 1.516 -0.349 0 CA-C-O 118.609 -0.71 . . . . 0.0 112.322 -177.858 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 34' ' ' ALA . . . . . . . . . . . . . . . -58.47 -52.73 64.38 Favored 'General case' 0 N--CA 1.45 -0.439 0 N-CA-C 108.251 -1.018 . . . . 0.0 108.251 178.47 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 11.7 tt0 -68.01 -34.98 77.53 Favored 'General case' 0 CA--C 1.533 0.322 0 N-CA-C 113.003 0.742 . . . . 0.0 113.003 -178.853 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 36' ' ' ASP . . . . . . . . . . . . . 30.3 t70 -65.03 -40.78 95.35 Favored 'General case' 0 C--N 1.332 -0.18 0 C-N-CA 125.122 1.369 . . . . 0.0 108.847 179.389 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 37' ' ' SER . . . . . . . . . . . . . 72.4 m -79.77 -12.89 59.76 Favored 'General case' 0 N--CA 1.45 -0.435 0 C-N-CA 123.09 0.556 . . . . 0.0 110.58 178.459 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 79.07 23.55 63.39 Favored Glycine 0 CA--C 1.523 0.589 0 CA-C-O 118.219 -1.323 . . . . 0.0 114.716 179.012 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 39' ' ' LEU . . . . . . . . . . . . . 33.4 mt -122.55 147.49 46.32 Favored 'General case' 0 N--CA 1.455 -0.213 0 CA-C-N 119.898 1.849 . . . . 0.0 106.106 179.225 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 40' ' ' THR . . . . . . . . . . . . . 5.5 t -64.31 152.46 41.08 Favored 'General case' 0 C--N 1.324 -0.509 0 O-C-N 120.959 -1.088 . . . . 0.0 108.251 179.298 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 41' ' ' VAL . . . . . . . . . . . . . 42.0 t -49.94 -44.84 21.84 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.353 0 O-C-N 121.242 -0.911 . . . . 0.0 110.691 179.399 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 42' ' ' SER . . . . . . . . . . . . . 3.7 p -59.74 -35.6 74.91 Favored 'General case' 0 CA--C 1.542 0.645 0 O-C-N 121.178 -0.951 . . . . 0.0 111.776 -179.863 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -75.93 -43.16 46.33 Favored 'General case' 0 C--O 1.22 -0.489 0 C-N-CA 124.186 0.994 . . . . 0.0 108.595 178.465 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 44' ' ' TYR . . . . . . . . . . . . . 56.3 t80 -55.54 -48.02 75.38 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 124.098 0.959 . . . . 0.0 108.744 178.927 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 45' ' ' ILE . . . . . . . . . . . . . 26.0 mm -61.32 -55.9 21.47 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.151 0 C-N-CA 123.718 0.807 . . . . 0.0 111.72 179.747 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 46' ' ' ARG . . . . . . . . . . . . . 21.0 ptt180 -59.13 -44.04 92.02 Favored 'General case' 0 C--O 1.222 -0.348 0 CA-C-N 118.863 0.756 . . . . 0.0 109.764 -179.259 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 47' ' ' ASN . . . . . . . . . . . . . 15.3 t30 -56.51 -59.65 4.68 Favored 'General case' 0 N--CA 1.451 -0.399 0 C-N-CA 124.24 1.016 . . . . 0.0 110.714 179.916 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -58.58 -31.58 68.15 Favored 'General case' 0 CA--C 1.529 0.158 0 N-CA-C 113.456 0.91 . . . . 0.0 113.456 -178.767 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 49' ' ' ALA . . . . . . . . . . . . . . . -78.91 -34.7 44.43 Favored 'General case' 0 N--CA 1.452 -0.357 0 N-CA-C 113.773 1.027 . . . . 0.0 113.773 -179.368 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 30.7 mt -81.23 -35.15 31.6 Favored 'General case' 0 C--N 1.329 -0.316 0 O-C-N 121.59 -0.694 . . . . 0.0 112.408 -178.976 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 51' ' ' ASN . . . . . . . . . . . . . 35.7 m-80 . . . . . 0 C--O 1.252 1.221 0 CA-C-O 115.936 -1.983 . . . . 0.0 114.86 -179.329 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.471 0.585 0 N-CA-C 104.169 -2.53 . . . . 0.0 104.169 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 8.5 p-10 -170.22 -174.01 1.63 Allowed 'General case' 0 C--N 1.322 -0.613 0 C-N-CA 129.398 3.079 . . . . 0.0 104.95 -177.498 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . 0.452 ' HB2' HG12 ' A' ' 5' ' ' VAL . 58.9 p -144.3 118.37 9.45 Favored 'General case' 0 N--CA 1.449 -0.524 0 N-CA-C 108.422 -0.955 . . . . 0.0 108.422 178.642 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -64.0 -14.87 57.35 Favored 'General case' 0 CA--C 1.539 0.52 0 O-C-N 121.107 -0.996 . . . . 0.0 111.317 178.952 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.452 HG12 ' HB2' ' A' ' 3' ' ' SER . 6.8 p -64.75 -17.64 21.94 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.547 0 C-N-CA 125.856 1.662 . . . . 0.0 113.507 179.531 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 23.0 mmm180 -65.4 167.51 8.52 Favored 'General case' 0 CA--C 1.531 0.244 0 CA-C-O 121.964 0.888 . . . . 0.0 112.754 -178.727 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 40.7 ttmt -120.75 68.86 0.87 Allowed 'General case' 0 CA--C 1.529 0.141 0 C-N-CA 126.449 1.899 . . . . 0.0 107.926 179.683 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 58.6 tttp -66.56 -52.06 49.73 Favored 'General case' 0 C--O 1.235 0.317 0 O-C-N 121.51 -0.744 . . . . 0.0 111.244 -179.757 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 31.6 m -78.36 154.15 31.02 Favored 'General case' 0 N--CA 1.45 -0.467 0 CA-C-O 121.155 0.503 . . . . 0.0 110.753 -179.809 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -148.02 -6.9 0.43 Allowed 'General case' 0 C--N 1.328 -0.367 0 C-N-CA 125.651 1.58 . . . . 0.0 112.776 178.277 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 7.7 p -54.87 121.95 3.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 C-N-CA 127.228 2.211 . . . . 0.0 109.564 -179.675 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 25.6 ttp180 50.91 36.15 14.18 Favored 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 123.754 0.822 . . . . 0.0 111.158 179.829 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 30.7 mt-30 59.46 19.69 8.07 Favored 'General case' 0 N--CA 1.47 0.532 0 O-C-N 120.319 -1.488 . . . . 0.0 111.98 -178.41 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 22.1 pttt 44.25 38.82 2.61 Favored 'General case' 0 C--N 1.345 0.412 0 C-N-CA 128.269 2.628 . . . . 0.0 108.684 -178.109 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . 0.407 ' HA ' ' O ' ' B' ' 22' ' ' PHE . 2.8 t -160.45 -166.51 1.67 Allowed 'General case' 0 N--CA 1.433 -1.283 0 C-N-CA 124.45 1.1 . . . . 0.0 109.079 -178.415 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.443 HG21 ' HB2' ' B' ' 27' ' ' ASP . 16.0 t -141.74 150.12 19.59 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.53 0 N-CA-C 104.08 -2.563 . . . . 0.0 104.08 178.161 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 14.6 p -145.19 113.94 1.52 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.491 0 N-CA-C 106.677 -1.601 . . . . 0.0 106.677 178.39 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 60.4 ttt-85 -147.83 161.94 40.25 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 106.783 -1.562 . . . . 0.0 106.783 179.465 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -92.99 133.55 36.02 Favored 'General case' 0 N--CA 1.442 -0.834 0 N-CA-C 104.688 -2.338 . . . . 0.0 104.688 178.056 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.536 HD13 ' H ' ' A' ' 21' ' ' ARG . 0.2 OUTLIER -115.6 159.33 21.44 Favored 'General case' 0 C--O 1.238 0.488 0 N-CA-C 105.673 -1.973 . . . . 0.0 105.673 178.34 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.536 ' H ' HD13 ' A' ' 20' ' ' LEU . 17.4 mmt85 -128.91 150.18 50.47 Favored 'General case' 0 CA--C 1.512 -0.505 0 C-N-CA 124.055 0.942 . . . . 0.0 109.565 -179.759 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . 0.464 ' O ' ' HA ' ' B' ' 15' ' ' THR . 90.0 m-85 -142.3 149.83 40.03 Favored 'General case' 0 CA--C 1.515 -0.379 0 N-CA-C 107.568 -1.271 . . . . 0.0 107.568 179.106 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . 0.488 ' HB3' ' HD2' ' A' ' 24' ' ' PRO . 2.0 m -85.67 -175.62 0.65 Allowed Pre-proline 0 CA--C 1.55 0.965 0 C-N-CA 125.021 1.328 . . . . 0.0 111.091 -179.109 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . 0.488 ' HD2' ' HB3' ' A' ' 23' ' ' SER . 39.4 Cg_endo -65.7 -55.06 0.47 Allowed 'Trans proline' 0 C--N 1.357 1.004 0 CA-C-N 121.94 1.729 . . . . 0.0 110.879 -179.485 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 59.9 t -62.0 -40.8 88.61 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.291 0 C-N-CA 123.11 0.564 . . . . 0.0 110.393 -179.772 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -58.46 -50.94 71.92 Favored 'General case' 0 C--O 1.228 -0.051 0 CA-C-N 118.376 0.535 . . . . 0.0 111.597 -179.048 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -65.09 -46.0 82.91 Favored 'General case' 0 CA--C 1.51 -0.563 0 C-N-CA 122.724 0.41 . . . . 0.0 111.311 -179.958 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 39.8 tt0 -54.12 -52.69 60.24 Favored 'General case' 0 N--CA 1.445 -0.708 0 C-N-CA 124.366 1.066 . . . . 0.0 109.69 -179.862 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 22.6 m -63.37 -54.03 43.2 Favored 'General case' 0 N--CA 1.449 -0.493 0 C-N-CA 124.309 1.043 . . . . 0.0 111.034 -179.786 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 34.0 mt -55.55 -44.72 77.46 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.243 0 CA-C-N 118.399 0.545 . . . . 0.0 110.396 -179.331 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 70.1 ttt-85 -62.56 -45.26 93.75 Favored 'General case' 0 C--N 1.33 -0.281 0 C-N-CA 123.179 0.592 . . . . 0.0 110.478 -179.75 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 4.2 mptp? -62.52 -49.21 76.25 Favored 'General case' 0 CA--C 1.517 -0.298 0 C-N-CA 123.085 0.554 . . . . 0.0 109.979 -179.608 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 30.7 tptt -62.12 -50.92 69.97 Favored 'General case' 0 N--CA 1.448 -0.56 0 C-N-CA 122.72 0.408 . . . . 0.0 109.954 -179.331 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -57.0 -47.3 81.15 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 123.824 0.85 . . . . 0.0 111.942 -178.721 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 19.9 tt0 -68.71 -22.46 64.35 Favored 'General case' 0 C--O 1.236 0.394 0 O-C-N 121.147 -0.971 . . . . 0.0 111.018 -179.391 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 24.0 t0 -87.9 -35.73 17.54 Favored 'General case' 0 CA--C 1.522 -0.106 0 C-N-CA 123.635 0.774 . . . . 0.0 110.452 -179.574 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 3.8 t -85.96 -11.43 53.08 Favored 'General case' 0 CA--C 1.536 0.416 0 O-C-N 121.351 -0.843 . . . . 0.0 110.345 179.088 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 86.44 -14.59 54.39 Favored Glycine 0 CA--C 1.527 0.82 0 C-N-CA 125.664 1.602 . . . . 0.0 112.453 -179.669 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 72.2 mt -75.31 112.06 11.21 Favored 'General case' 0 CA--C 1.506 -0.729 0 N-CA-C 105.098 -2.186 . . . . 0.0 105.098 -179.616 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 1.7 t -49.21 152.57 1.15 Allowed 'General case' 0 CA--C 1.538 0.505 0 N-CA-C 108.448 -0.945 . . . . 0.0 108.448 178.645 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 24.3 t -46.5 -35.57 2.61 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.418 0 C-N-CA 125.448 1.499 . . . . 0.0 112.063 -179.326 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -70.84 -47.82 57.27 Favored 'General case' 0 CA--C 1.539 0.535 0 O-C-N 121.337 -0.852 . . . . 0.0 110.325 178.058 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -61.75 -43.3 99.12 Favored 'General case' 0 C--O 1.224 -0.243 0 C-N-CA 124.73 1.212 . . . . 0.0 110.126 179.131 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 61.7 t80 -54.41 -52.89 60.32 Favored 'General case' 0 N--CA 1.449 -0.511 0 C-N-CA 125.247 1.419 . . . . 0.0 109.289 179.658 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.461 HG23 HG23 ' B' ' 45' ' ' ILE . 20.8 mm -56.55 -60.15 2.22 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.209 0 C-N-CA 123.306 0.642 . . . . 0.0 112.439 179.657 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 11.8 ptm180 -57.27 -44.45 83.96 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-N 118.277 0.49 . . . . 0.0 111.3 -178.775 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 22.8 t30 -57.91 -53.7 55.23 Favored 'General case' 0 N--CA 1.455 -0.221 0 C-N-CA 123.722 0.809 . . . . 0.0 112.019 -179.508 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -62.45 -34.16 76.25 Favored 'General case' 0 C--N 1.334 -0.074 0 N-CA-C 113.017 0.747 . . . . 0.0 113.017 -179.435 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -70.7 -41.82 71.47 Favored 'General case' 0 N--CA 1.448 -0.525 0 N-CA-C 111.971 0.36 . . . . 0.0 111.971 -178.719 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 17.6 mt -74.58 -40.96 61.3 Favored 'General case' 0 CA--C 1.513 -0.452 0 C-N-CA 123.028 0.531 . . . . 0.0 112.098 -178.623 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 43.8 m-80 . . . . . 0 C--O 1.252 1.221 0 O-C-N 124.194 0.934 . . . . 0.0 108.621 179.765 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 1' ' ' SER . . . . . . . . . . . . . 1.4 t . . . . . 0 N--CA 1.474 0.757 0 N-CA-C 101.935 -3.357 . . . . 0.0 101.935 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 2' ' ' ASP . . . . . . . . . . . . . 6.0 p-10 -170.41 -166.0 0.49 Allowed 'General case' 0 N--CA 1.444 -0.746 0 C-N-CA 126.584 1.954 . . . . 0.0 106.216 -174.949 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 3' ' ' SER . . . . . . . . . . . . . 8.4 m -138.91 172.18 13.23 Favored 'General case' 0 C--N 1.33 -0.268 0 C-N-CA 124.524 1.13 . . . . 0.0 108.934 -179.885 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 4' ' ' ALA . . . . . . . . . . . . . . . -109.31 -3.87 16.85 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 125.151 1.38 . . . . 0.0 112.023 179.979 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 17.1 t -76.02 -28.34 18.79 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.601 0 C-N-CA 124.13 0.972 . . . . 0.0 112.252 -179.171 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 6' ' ' ARG . . . . . . . . . . . . . 26.2 mmm180 -71.7 154.22 41.51 Favored 'General case' 0 C--O 1.237 0.415 0 O-C-N 120.239 -1.538 . . . . 0.0 110.194 -179.376 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 34.5 mtmt -110.81 160.05 17.1 Favored 'General case' 0 C--N 1.329 -0.317 0 C-N-CA 124.711 1.204 . . . . 0.0 107.902 179.117 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 62.4 tttp -138.32 -70.65 0.43 Allowed 'General case' 0 C--O 1.232 0.183 0 C-N-CA 124.031 0.933 . . . . 0.0 108.875 179.714 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 39.2 m -66.34 120.14 12.78 Favored 'General case' 0 N--CA 1.454 -0.265 0 C-N-CA 123.925 0.89 . . . . 0.0 110.152 179.23 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 10' ' ' GLU . . . . . 0.415 ' CD ' ' H ' ' B' ' 10' ' ' GLU . 0.0 OUTLIER -115.4 -8.73 12.21 Favored 'General case' 0 C--O 1.236 0.376 0 C-N-CA 127.636 2.374 . . . . 0.0 113.079 179.58 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 11' ' ' VAL . . . . . . . . . . . . . 79.6 t -58.91 135.13 23.68 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 N-CA-C 105.506 -2.035 . . . . 0.0 105.506 179.14 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 12' ' ' ARG . . . . . . . . . . . . . 7.2 ptp180 47.88 24.05 0.54 Allowed 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 125.714 1.606 . . . . 0.0 113.492 -179.477 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 13' ' ' GLN . . . . . . . . . . . . . 39.7 mt-30 61.01 25.88 15.88 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-N 120.607 1.549 . . . . 0.0 110.302 -177.64 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 56.4 pttt 46.08 33.15 1.6 Allowed 'General case' 0 C--N 1.349 0.551 0 C-N-CA 126.795 2.038 . . . . 0.0 109.144 -178.221 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 15' ' ' THR . . . . . 0.464 ' HA ' ' O ' ' A' ' 22' ' ' PHE . 6.9 t -154.43 -171.92 4.03 Favored 'General case' 0 N--CA 1.432 -1.327 0 CA-C-O 121.845 0.831 . . . . 0.0 111.077 -177.55 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 36.1 t -136.67 145.11 30.83 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.426 0 N-CA-C 104.225 -2.509 . . . . 0.0 104.225 178.856 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 12.3 p -130.93 112.57 22.37 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.697 0 N-CA-C 104.938 -2.245 . . . . 0.0 104.938 178.923 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 4.4 ttt-85 -142.84 146.75 34.44 Favored 'General case' 0 CA--C 1.51 -0.584 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.804 -179.646 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 87.4 m -93.34 117.96 30.71 Favored 'General case' 0 C--O 1.239 0.514 0 N-CA-C 104.715 -2.328 . . . . 0.0 104.715 178.391 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 14.6 tp -120.38 138.54 53.69 Favored 'General case' 0 C--O 1.236 0.395 0 C-N-CA 124.434 1.094 . . . . 0.0 108.869 -178.742 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 11.2 mtt85 -116.15 161.32 19.11 Favored 'General case' 0 CA--C 1.519 -0.24 0 C-N-CA 124.142 0.977 . . . . 0.0 111.562 -179.177 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 22' ' ' PHE . . . . . 0.407 ' O ' ' HA ' ' A' ' 15' ' ' THR . 82.1 m-85 -143.83 157.64 44.23 Favored 'General case' 0 C--N 1.33 -0.258 0 C-N-CA 125.298 1.439 . . . . 0.0 108.019 -179.839 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 50.3 m -79.94 170.44 15.84 Favored Pre-proline 0 CA--C 1.548 0.89 0 C-N-CA 125.241 1.416 . . . . 0.0 107.369 178.344 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 24' ' ' PRO . . . . . . . . . . . . . 60.8 Cg_endo -69.12 -42.82 3.68 Favored 'Trans proline' 0 C--N 1.347 0.448 0 CA-C-N 121.345 1.516 . . . . 0.0 111.063 -178.868 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 25' ' ' VAL . . . . . . . . . . . . . 4.2 t -60.84 -39.16 80.97 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.475 0 C-N-CA 124.013 0.925 . . . . 0.0 108.916 179.762 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 81.3 mt-10 -69.46 -49.78 51.75 Favored 'General case' 0 C--O 1.22 -0.497 0 C-N-CA 123.55 0.74 . . . . 0.0 109.783 179.685 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 27' ' ' ASP . . . . . 0.443 ' HB2' HG21 ' A' ' 16' ' ' VAL . 2.6 t70 -56.09 -43.29 77.9 Favored 'General case' 0 CA--C 1.513 -0.448 0 C-N-CA 124.559 1.144 . . . . 0.0 111.477 179.635 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 28' ' ' GLU . . . . . . . . . . . . . 34.8 tt0 -65.09 -50.44 66.1 Favored 'General case' 0 N--CA 1.445 -0.724 0 O-C-N 123.927 0.767 . . . . 0.0 108.946 179.773 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 60.5 m -58.68 -51.78 68.48 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 122.979 0.512 . . . . 0.0 109.66 179.692 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 83.9 mt -58.45 -43.8 87.5 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.23 0 C-N-CA 124.337 1.055 . . . . 0.0 109.546 -179.803 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 64.9 ttt180 -62.82 -49.57 74.41 Favored 'General case' 0 CA--C 1.519 -0.223 0 O-C-N 121.587 -0.695 . . . . 0.0 110.005 179.737 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 5.1 mptp? -62.28 -42.99 99.82 Favored 'General case' 0 N--CA 1.454 -0.242 0 CA-C-O 118.044 -0.979 . . . . 0.0 110.408 -179.741 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 33' ' ' LYS . . . . . 0.433 ' HD2' ' HA ' ' B' ' 33' ' ' LYS . 34.7 tptt -70.37 -37.74 74.63 Favored 'General case' 0 CA--C 1.521 -0.135 0 CA-C-N 119.715 1.143 . . . . 0.0 111.369 -179.413 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 34' ' ' ALA . . . . . . . . . . . . . . . -60.82 -49.12 78.76 Favored 'General case' 0 N--CA 1.453 -0.303 0 N-CA-C 107.259 -1.385 . . . . 0.0 107.259 177.999 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 67.9 tt0 -60.7 -44.64 96.32 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 124.233 1.013 . . . . 0.0 110.863 179.85 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 36' ' ' ASP . . . . . . . . . . . . . 20.8 t70 -62.19 -41.73 98.61 Favored 'General case' 0 CA--C 1.519 -0.214 0 C-N-CA 126.781 2.033 . . . . 0.0 110.19 -179.436 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 37' ' ' SER . . . . . . . . . . . . . 8.0 t -82.16 -10.44 59.17 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 123.058 0.543 . . . . 0.0 111.159 179.527 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 71.41 10.95 71.24 Favored Glycine 0 CA--C 1.533 1.17 0 O-C-N 120.776 -1.203 . . . . 0.0 111.302 -178.761 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 39' ' ' LEU . . . . . . . . . . . . . 27.2 mt -107.07 112.63 25.64 Favored 'General case' 0 N--CA 1.451 -0.399 0 C-N-CA 126.486 1.914 . . . . 0.0 106.173 -179.93 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 40' ' ' THR . . . . . . . . . . . . . 6.4 t -45.51 153.78 0.23 Allowed 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 125.957 1.703 . . . . 0.0 110.156 179.476 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 41' ' ' VAL . . . . . . . . . . . . . 89.4 t -45.62 -45.41 4.49 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.246 0 C-N-CA 124.621 1.168 . . . . 0.0 111.686 -178.683 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 42' ' ' SER . . . . . . . . . . . . . 4.3 p -63.64 -42.92 98.09 Favored 'General case' 0 CA--C 1.541 0.628 0 O-C-N 121.117 -0.989 . . . . 0.0 112.063 179.597 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -65.26 -43.42 91.36 Favored 'General case' 0 C--N 1.34 0.157 0 C-N-CA 125.03 1.332 . . . . 0.0 109.193 178.956 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 44' ' ' TYR . . . . . . . . . . . . . 84.8 t80 -58.1 -52.28 66.21 Favored 'General case' 0 N--CA 1.448 -0.527 0 C-N-CA 125.26 1.424 . . . . 0.0 108.497 179.298 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 45' ' ' ILE . . . . . 0.461 HG23 HG23 ' A' ' 45' ' ' ILE . 16.8 mm -57.51 -62.61 0.87 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.393 0 C-N-CA 123.961 0.904 . . . . 0.0 111.261 179.81 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 46' ' ' ARG . . . . . . . . . . . . . 9.0 ptm180 -53.59 -41.17 66.31 Favored 'General case' 0 C--O 1.224 -0.287 0 CA-C-O 118.057 -0.973 . . . . 0.0 112.558 -178.664 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 47' ' ' ASN . . . . . . . . . . . . . 16.1 t30 -70.62 -52.2 22.96 Favored 'General case' 0 N--CA 1.453 -0.321 0 C-N-CA 124.502 1.121 . . . . 0.0 111.187 -179.348 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -58.4 -31.45 67.71 Favored 'General case' 0 CA--C 1.53 0.178 0 C-N-CA 122.908 0.483 . . . . 0.0 112.016 -179.175 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 49' ' ' ALA . . . . . . . . . . . . . . . -74.83 -21.05 59.5 Favored 'General case' 0 N--CA 1.445 -0.686 0 N-CA-C 114.761 1.393 . . . . 0.0 114.761 -179.476 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 10.8 mt -105.38 -34.84 7.71 Favored 'General case' 0 N--CA 1.469 0.52 0 N-CA-C 113.757 1.021 . . . . 0.0 113.757 -178.391 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 51' ' ' ASN . . . . . . . . . . . . . 26.3 m-80 . . . . . 0 C--O 1.252 1.232 0 CA-C-O 116.214 -1.85 . . . . 0.0 113.528 -178.307 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 1.4 p . . . . . 0 CA--C 1.51 -0.573 0 N-CA-C 103.662 -2.718 . . . . 0.0 103.662 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 12.0 t70 -74.58 160.68 30.55 Favored 'General case' 0 C--O 1.24 0.598 0 N-CA-C 105.519 -2.03 . . . . 0.0 105.519 176.182 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 70.1 m -143.0 93.83 2.55 Favored 'General case' 0 N--CA 1.443 -0.777 0 N-CA-C 104.16 -2.533 . . . . 0.0 104.16 179.109 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -53.47 -8.62 0.15 Allowed 'General case' 0 C--O 1.243 0.755 0 N-CA-C 116.452 2.019 . . . . 0.0 116.452 -178.834 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 11.3 p -62.37 141.69 17.54 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.346 0 N-CA-C 106.604 -1.628 . . . . 0.0 106.604 178.294 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -144.33 164.06 31.9 Favored 'General case' 0 C--O 1.236 0.386 0 O-C-N 120.517 -1.364 . . . . 0.0 110.961 -179.48 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -87.21 178.51 6.86 Favored 'General case' 0 C--O 1.237 0.431 0 N-CA-C 107.7 -1.222 . . . . 0.0 107.7 178.338 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 35.4 pttt -152.36 -178.9 7.1 Favored 'General case' 0 C--N 1.321 -0.649 0 C-N-CA 126.952 2.101 . . . . 0.0 105.652 178.551 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 50.3 p -132.18 135.09 46.09 Favored 'General case' 0 N--CA 1.442 -0.852 0 N-CA-C 105.348 -2.093 . . . . 0.0 105.348 178.67 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.7 pm0 -123.06 5.04 9.29 Favored 'General case' 0 C--N 1.323 -0.544 0 C-N-CA 124.874 1.27 . . . . 0.0 110.391 179.805 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.405 HG22 ' H ' ' A' ' 11' ' ' VAL . 1.3 m -71.43 -50.74 38.34 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.289 0 C-N-CA 126.319 1.847 . . . . 0.0 111.673 179.074 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 13.4 ttm180 -68.91 156.78 37.9 Favored 'General case' 0 C--O 1.236 0.373 0 C-N-CA 123.795 0.838 . . . . 0.0 111.443 -178.214 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 8.1 pt20 -87.87 66.51 8.76 Favored 'General case' 0 C--N 1.331 -0.197 0 N-CA-C 107.648 -1.242 . . . . 0.0 107.648 178.242 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 14.8 pttm -64.51 -41.4 96.43 Favored 'General case' 0 C--O 1.225 -0.204 0 N-CA-C 108.43 -0.952 . . . . 0.0 108.43 178.991 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 11.4 t -65.48 148.28 51.98 Favored 'General case' 0 N--CA 1.439 -1.025 0 N-CA-C 107.305 -1.369 . . . . 0.0 107.305 177.995 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 2.3 p -80.2 148.8 5.49 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.01 0 N-CA-C 105.515 -2.032 . . . . 0.0 105.515 178.245 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 13.1 p -144.81 114.0 1.68 Allowed 'Isoleucine or valine' 0 N--CA 1.441 -0.914 0 N-CA-C 107.541 -1.281 . . . . 0.0 107.541 177.692 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 17.0 ttt85 -145.47 177.72 8.64 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 106.57 -1.641 . . . . 0.0 106.57 178.951 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 29.5 m -128.35 139.69 52.25 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 104.346 -2.464 . . . . 0.0 104.346 179.156 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 77.8 mt -120.16 169.08 10.57 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-N 118.626 0.648 . . . . 0.0 109.764 179.605 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 12.3 mmt-85 -137.81 136.09 36.89 Favored 'General case' 0 C--O 1.237 0.397 0 C-N-CA 126.281 1.832 . . . . 0.0 109.38 -179.975 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . 0.41 ' H ' HG13 ' B' ' 16' ' ' VAL . 24.6 m-85 -133.95 152.58 51.91 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 106.715 -1.587 . . . . 0.0 106.715 178.76 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 4.9 m -69.04 166.93 23.43 Favored Pre-proline 0 CA--C 1.543 0.681 0 N-CA-C 107.734 -1.21 . . . . 0.0 107.734 178.929 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 19.5 Cg_endo -56.84 -48.62 17.66 Favored 'Trans proline' 0 N--CA 1.461 -0.425 0 C-N-CA 121.801 1.667 . . . . 0.0 112.21 -178.975 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 98.0 t -59.94 -43.67 92.81 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.471 0 C-N-CA 126.171 1.788 . . . . 0.0 110.722 179.861 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 88.0 mt-10 -67.39 -46.05 74.43 Favored 'General case' 0 C--N 1.334 -0.076 0 C-N-CA 124.991 1.316 . . . . 0.0 110.7 -178.827 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 30.5 t70 -62.4 -42.11 99.18 Favored 'General case' 0 CA--C 1.519 -0.213 0 N-CA-C 109.12 -0.696 . . . . 0.0 109.12 179.443 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 16.5 tt0 -66.28 -37.03 84.5 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 124.298 1.039 . . . . 0.0 109.79 178.883 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 95.3 m -64.35 -55.05 23.8 Favored 'General case' 0 CA--C 1.531 0.224 0 N-CA-C 106.949 -1.5 . . . . 0.0 106.949 178.68 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 75.1 mt -56.46 -45.68 81.95 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.247 0 C-N-CA 124.219 1.008 . . . . 0.0 108.987 -179.882 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 74.6 ttt180 -59.95 -47.54 85.38 Favored 'General case' 0 N--CA 1.457 -0.091 0 C-N-CA 123.511 0.724 . . . . 0.0 110.966 -179.785 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 11.7 mptt -64.02 -48.73 75.16 Favored 'General case' 0 CA--C 1.522 -0.109 0 CA-C-O 118.15 -0.928 . . . . 0.0 110.647 -179.792 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 24.9 mmtp -60.6 -46.12 91.42 Favored 'General case' 0 N--CA 1.463 0.213 0 CA-C-N 119.019 0.827 . . . . 0.0 109.915 -179.539 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -56.93 -55.28 36.63 Favored 'General case' 0 N--CA 1.454 -0.23 0 C-N-CA 124.013 0.925 . . . . 0.0 110.286 179.787 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 27.5 tt0 -64.43 -35.07 79.72 Favored 'General case' 0 N--CA 1.455 -0.21 0 CA-C-O 119.072 -0.49 . . . . 0.0 112.193 -178.761 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 41.8 t0 -66.21 -39.74 89.85 Favored 'General case' 0 N--CA 1.466 0.325 0 N-CA-C 107.838 -1.171 . . . . 0.0 107.838 179.484 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 22.9 t -75.57 -10.63 59.61 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 125.482 1.513 . . . . 0.0 110.211 178.374 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 73.06 4.15 62.3 Favored Glycine 0 CA--C 1.531 1.068 0 C-N-CA 125.551 1.548 . . . . 0.0 113.962 -179.984 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 12.9 mt -106.34 128.03 53.7 Favored 'General case' 0 CA--C 1.51 -0.584 0 N-CA-C 105.414 -2.069 . . . . 0.0 105.414 179.749 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 8.7 t -50.82 152.43 2.1 Favored 'General case' 0 CA--C 1.539 0.546 0 CA-C-O 121.435 0.636 . . . . 0.0 110.571 179.256 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 52.0 t -46.63 -40.49 4.55 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.166 0 C-N-CA 126.089 1.756 . . . . 0.0 111.908 -179.78 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 3.5 p -61.46 -42.58 99.0 Favored 'General case' 0 CA--C 1.535 0.365 0 CA-C-N 119.567 1.076 . . . . 0.0 111.37 -179.732 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -70.65 -42.13 71.23 Favored 'General case' 0 C--O 1.222 -0.391 0 N-CA-C 108.527 -0.916 . . . . 0.0 108.527 178.343 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 56.0 t80 -55.08 -51.5 66.19 Favored 'General case' 0 CA--C 1.535 0.396 0 CA-C-N 118.838 0.745 . . . . 0.0 109.083 179.235 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 18.1 mm -56.83 -61.44 1.23 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.19 0 C-N-CA 125.173 1.389 . . . . 0.0 110.207 179.686 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 11.8 ptt180 -51.58 -44.3 62.73 Favored 'General case' 0 C--O 1.222 -0.377 0 C-N-CA 123.655 0.782 . . . . 0.0 110.738 -179.135 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 2.2 t30 -62.07 -56.85 14.81 Favored 'General case' 0 N--CA 1.452 -0.338 0 C-N-CA 123.882 0.873 . . . . 0.0 110.031 179.016 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -59.12 -32.05 69.49 Favored 'General case' 0 C--O 1.224 -0.256 0 N-CA-C 113.521 0.934 . . . . 0.0 113.521 -178.645 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -76.28 -24.5 54.45 Favored 'General case' 0 CA--C 1.533 0.322 0 N-CA-C 113.696 0.999 . . . . 0.0 113.696 -179.485 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 17.9 mt -97.46 -28.3 14.05 Favored 'General case' 0 N--CA 1.466 0.339 0 C-N-CA 123.18 0.592 . . . . 0.0 110.288 179.62 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 43.1 m-80 . . . . . 0 C--O 1.253 1.276 0 C-N-CA 125.521 1.528 . . . . 0.0 108.335 179.133 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' B' B ' 1' ' ' SER . . . . . . . . . . . . . 1.5 p . . . . . 0 CA--C 1.51 -0.562 0 N-CA-C 103.874 -2.639 . . . . 0.0 103.874 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' B' B ' 2' ' ' ASP . . . . . . . . . . . . . 11.8 t70 -75.3 162.84 28.07 Favored 'General case' 0 C--O 1.241 0.638 0 N-CA-C 105.87 -1.9 . . . . 0.0 105.87 176.379 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 3' ' ' SER . . . . . . . . . . . . . 74.7 m -139.61 85.61 2.06 Favored 'General case' 0 N--CA 1.446 -0.643 0 N-CA-C 104.088 -2.56 . . . . 0.0 104.088 179.079 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 4' ' ' ALA . . . . . . . . . . . . . . . -62.33 76.3 0.02 OUTLIER 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 126.129 1.772 . . . . 0.0 113.832 -178.836 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 9.1 p -144.22 148.05 18.91 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.309 0 N-CA-C 105.635 -1.987 . . . . 0.0 105.635 178.733 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 6' ' ' ARG . . . . . . . . . . . . . 9.1 ptm180 -148.87 137.43 21.18 Favored 'General case' 0 C--O 1.236 0.359 0 O-C-N 120.568 -1.333 . . . . 0.0 110.313 -179.038 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.65 165.24 25.46 Favored 'General case' 0 C--O 1.236 0.387 0 N-CA-C 108.923 -0.769 . . . . 0.0 108.923 179.366 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 25.9 pttm -128.56 -177.4 4.16 Favored 'General case' 0 C--N 1.328 -0.35 0 C-N-CA 125.226 1.41 . . . . 0.0 110.046 179.871 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 3.3 p -120.11 85.7 2.43 Favored 'General case' 0 N--CA 1.454 -0.253 0 C-N-CA 124.683 1.193 . . . . 0.0 108.513 -179.802 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 10' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -70.87 -12.9 61.82 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 114.235 1.198 . . . . 0.0 114.235 -179.753 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 11' ' ' VAL . . . . . . . . . . . . . 31.6 t -78.09 -52.78 15.33 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 C-N-CA 124.243 1.017 . . . . 0.0 108.626 179.83 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 12' ' ' ARG . . . . . . . . . . . . . 15.9 ttm180 -59.35 138.62 57.57 Favored 'General case' 0 C--N 1.343 0.307 0 N-CA-C 109.048 -0.723 . . . . 0.0 109.048 -179.564 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 13' ' ' GLN . . . . . . . . . . . . . 20.4 pt20 -73.44 71.28 1.29 Allowed 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 125.221 1.409 . . . . 0.0 111.904 179.613 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 22.3 pttm -59.2 -31.14 68.75 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 123.509 0.723 . . . . 0.0 110.903 178.606 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 5.5 t -70.08 -167.71 0.17 Allowed 'General case' 0 N--CA 1.443 -0.8 0 C-N-CA 126.595 1.958 . . . . 0.0 110.711 179.157 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 16' ' ' VAL . . . . . 0.41 HG13 ' H ' ' A' ' 22' ' ' PHE . 0.3 OUTLIER -130.24 148.46 33.16 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.794 0 N-CA-C 102.209 -3.256 . . . . 0.0 102.209 178.316 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 9.3 p -147.08 98.79 0.41 Allowed 'Isoleucine or valine' 0 N--CA 1.436 -1.173 0 N-CA-C 104.559 -2.386 . . . . 0.0 104.559 179.201 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 16.8 ttt85 -138.74 152.37 47.91 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.105 -0.952 . . . . 0.0 110.945 -179.265 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 19.6 m -91.73 135.89 33.56 Favored 'General case' 0 C--N 1.326 -0.435 0 C-N-CA 125.316 1.446 . . . . 0.0 108.195 179.92 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 20' ' ' LEU . . . . . 0.403 HD23 ' CZ ' ' B' ' 22' ' ' PHE . 0.2 OUTLIER -139.09 134.82 33.43 Favored 'General case' 0 C--O 1.237 0.407 0 N-CA-C 108.84 -0.8 . . . . 0.0 108.84 179.085 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 50.1 mtm-85 -115.67 159.1 21.79 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 124.475 1.11 . . . . 0.0 110.798 179.363 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 22' ' ' PHE . . . . . 0.403 ' CZ ' HD23 ' B' ' 20' ' ' LEU . 31.9 m-85 -145.43 154.24 42.04 Favored 'General case' 0 C--O 1.238 0.45 0 C-N-CA 125.398 1.479 . . . . 0.0 108.18 179.98 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 15.4 m -67.85 168.01 14.55 Favored Pre-proline 0 CA--C 1.537 0.46 0 N-CA-C 108.568 -0.901 . . . . 0.0 108.568 178.82 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 24' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -63.09 -42.19 24.6 Favored 'Trans proline' 0 N--CA 1.457 -0.63 0 CA-C-N 120.291 1.14 . . . . 0.0 109.329 179.356 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 25' ' ' VAL . . . . . . . . . . . . . 75.6 t -57.07 -44.75 83.53 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.585 0 C-N-CA 123.797 0.839 . . . . 0.0 109.637 178.925 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 49.3 mt-10 -66.23 -52.19 50.23 Favored 'General case' 0 N--CA 1.454 -0.23 0 C-N-CA 124.355 1.062 . . . . 0.0 110.392 -179.785 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 27' ' ' ASP . . . . . . . . . . . . . 34.9 t70 -60.27 -39.81 88.16 Favored 'General case' 0 C--O 1.223 -0.295 0 C-N-CA 123.692 0.797 . . . . 0.0 111.471 -179.237 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 28' ' ' GLU . . . . . . . . . . . . . 79.6 mt-10 -63.92 -50.91 66.85 Favored 'General case' 0 N--CA 1.453 -0.311 0 N-CA-C 107.616 -1.253 . . . . 0.0 107.616 178.506 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 90.2 m -55.1 -58.96 5.53 Favored 'General case' 0 CA--C 1.531 0.219 0 N-CA-C 109.104 -0.702 . . . . 0.0 109.104 179.618 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 92.9 mt -55.06 -47.03 77.53 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.353 0 C-N-CA 124.29 1.036 . . . . 0.0 110.132 -179.286 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 61.7 ttt180 -58.9 -48.83 80.05 Favored 'General case' 0 CA--C 1.52 -0.207 0 CA-C-N 119.093 0.861 . . . . 0.0 110.542 -179.752 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 10.6 mptt -61.7 -49.18 77.49 Favored 'General case' 0 C--O 1.22 -0.466 0 CA-C-O 118.546 -0.74 . . . . 0.0 109.889 -179.248 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 22.8 mmtp -56.71 -49.79 74.1 Favored 'General case' 0 CA--C 1.517 -0.319 0 C-N-CA 124.32 1.048 . . . . 0.0 109.574 -178.664 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 34' ' ' ALA . . . . . . . . . . . . . . . -56.19 -58.58 7.36 Favored 'General case' 0 N--CA 1.446 -0.646 0 C-N-CA 125.858 1.663 . . . . 0.0 110.5 179.967 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 11.6 tt0 -67.38 -20.21 65.52 Favored 'General case' 0 N--CA 1.467 0.391 0 N-CA-C 113.599 0.963 . . . . 0.0 113.599 -177.796 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 36' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -92.15 2.96 56.27 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 126.401 1.88 . . . . 0.0 110.7 178.884 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 37' ' ' SER . . . . . . . . . . . . . 18.6 t -122.59 -6.35 8.65 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 125.779 1.632 . . . . 0.0 111.021 -179.921 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 73.87 31.5 60.07 Favored Glycine 0 CA--C 1.527 0.783 0 N-CA-C 110.176 -1.169 . . . . 0.0 110.176 -179.455 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 39' ' ' LEU . . . . . . . . . . . . . 59.6 mt -128.19 129.56 46.66 Favored 'General case' 0 N--CA 1.446 -0.637 0 C-N-CA 125.959 1.704 . . . . 0.0 108.83 -178.491 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 40' ' ' THR . . . . . . . . . . . . . 1.8 t -66.59 152.4 45.37 Favored 'General case' 0 CA--C 1.541 0.611 0 N-CA-C 104.344 -2.465 . . . . 0.0 104.344 176.626 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 41' ' ' VAL . . . . . . . . . . . . . 55.0 t -47.58 -40.94 7.6 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.338 0 C-N-CA 124.596 1.158 . . . . 0.0 111.118 179.157 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 42' ' ' SER . . . . . . . . . . . . . 5.1 p -61.77 -44.21 97.33 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-N 120.007 1.276 . . . . 0.0 111.08 179.598 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -65.76 -40.53 92.13 Favored 'General case' 0 C--O 1.226 -0.18 0 C-N-CA 124.008 0.923 . . . . 0.0 109.059 178.776 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 44' ' ' TYR . . . . . . . . . . . . . 53.4 t80 -60.64 -52.64 64.28 Favored 'General case' 0 CA--C 1.534 0.35 0 N-CA-C 108.114 -1.069 . . . . 0.0 108.114 178.904 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 45' ' ' ILE . . . . . . . . . . . . . 23.2 mm -54.53 -62.19 0.8 Allowed 'Isoleucine or valine' 0 C--N 1.34 0.169 0 C-N-CA 124.537 1.135 . . . . 0.0 110.672 -179.888 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 46' ' ' ARG . . . . . . . . . . . . . 22.2 ptt180 -54.75 -47.03 74.34 Favored 'General case' 0 C--O 1.223 -0.291 0 CA-C-O 119.302 -0.38 . . . . 0.0 111.711 -178.856 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 47' ' ' ASN . . . . . . . . . . . . . 23.7 t30 -61.08 -52.04 66.62 Favored 'General case' 0 N--CA 1.448 -0.528 0 CA-C-O 118.282 -0.866 . . . . 0.0 111.132 -178.814 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -63.42 -27.86 69.58 Favored 'General case' 0 C--O 1.225 -0.223 0 C-N-CA 124.038 0.935 . . . . 0.0 112.075 179.776 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 49' ' ' ALA . . . . . . . . . . . . . . . -77.75 -34.8 52.29 Favored 'General case' 0 N--CA 1.457 -0.082 0 O-C-N 121.391 -0.818 . . . . 0.0 111.692 -179.914 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 38.1 mt -82.51 -46.16 13.77 Favored 'General case' 0 C--N 1.33 -0.249 0 C-N-CA 122.874 0.469 . . . . 0.0 110.629 -179.06 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 51' ' ' ASN . . . . . . . . . . . . . 42.5 m-80 . . . . . 0 C--O 1.248 0.981 0 C-N-CA 124.768 1.227 . . . . 0.0 110.668 -179.721 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 24.5 m . . . . . 0 N--CA 1.477 0.894 0 CA-C-O 121.499 0.666 . . . . 0.0 111.378 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -45.08 22.83 0.0 OUTLIER 'General case' 0 CA--C 1.538 0.498 1 C-N-CA 142.357 8.263 . . . . 0.0 115.89 -179.49 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 23.3 p -66.24 61.52 0.04 OUTLIER 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 129.754 3.222 . . . . 0.0 112.87 -179.725 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -55.92 -18.65 9.57 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 125.87 1.668 . . . . 0.0 115.355 -179.129 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 14.5 p -51.02 -32.71 12.28 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.45 0 C-N-CA 125.4 1.48 . . . . 0.0 114.563 -179.255 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 48.9 ttp180 -139.57 127.19 21.75 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 119.513 1.051 . . . . 0.0 110.077 -179.41 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 72.3 mttt -68.98 -67.03 0.5 Allowed 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 123.39 0.676 . . . . 0.0 109.794 179.277 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 37.6 mtpt -140.94 179.83 6.49 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 125.005 1.322 . . . . 0.0 108.631 179.391 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 5.1 t -141.5 117.5 10.56 Favored 'General case' 0 N--CA 1.453 -0.311 0 N-CA-C 106.209 -1.775 . . . . 0.0 106.209 179.461 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 13.3 pt-20 -117.68 1.77 12.23 Favored 'General case' 0 N--CA 1.473 0.715 0 N-CA-C 113.522 0.934 . . . . 0.0 113.522 -179.438 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 11.9 m -63.64 136.04 26.81 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.331 0 C-N-CA 124.126 0.97 . . . . 0.0 109.859 179.678 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 4.3 mmp_? -89.0 -32.86 17.4 Favored 'General case' 0 CA--C 1.517 -0.296 0 N-CA-C 113.189 0.811 . . . . 0.0 113.189 -178.98 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 82.5 mt-30 -76.41 96.79 4.11 Favored 'General case' 0 N--CA 1.454 -0.246 0 CA-C-O 121.651 0.738 . . . . 0.0 110.217 -178.885 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 21.2 ptmt -66.36 -33.1 74.96 Favored 'General case' 0 N--CA 1.462 0.159 0 N-CA-C 109.591 -0.522 . . . . 0.0 109.591 178.825 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 4.2 t -78.99 168.04 20.25 Favored 'General case' 0 N--CA 1.44 -0.941 0 C-N-CA 124.84 1.256 . . . . 0.0 108.793 179.306 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 95.2 t -97.86 145.34 9.66 Favored 'Isoleucine or valine' 0 CA--C 1.505 -0.755 0 C-N-CA 126.747 2.019 . . . . 0.0 105.918 179.308 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 7.8 p -145.62 99.95 0.51 Allowed 'Isoleucine or valine' 0 N--CA 1.441 -0.908 0 CA-C-O 122.6 1.191 . . . . 0.0 108.484 178.066 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 26.4 mtt-85 -143.12 157.39 44.56 Favored 'General case' 0 CA--C 1.511 -0.531 0 CA-C-N 115.084 -0.962 . . . . 0.0 110.234 178.824 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 96.6 m -86.42 100.5 12.39 Favored 'General case' 0 N--CA 1.446 -0.671 0 N-CA-C 106.664 -1.606 . . . . 0.0 106.664 179.548 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -95.4 86.68 4.57 Favored 'General case' 0 C--N 1.323 -0.579 0 C-N-CA 126.806 2.042 . . . . 0.0 107.321 -179.27 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 14.0 mtp180 -77.36 162.51 27.21 Favored 'General case' 0 N--CA 1.453 -0.316 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.64 179.246 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 92.7 m-85 -139.8 171.08 14.73 Favored 'General case' 0 CA--C 1.516 -0.349 0 C-N-CA 125.966 1.707 . . . . 0.0 108.068 178.985 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 7.7 m -106.2 172.56 3.83 Favored Pre-proline 0 CA--C 1.547 0.848 0 N-CA-C 108.063 -1.088 . . . . 0.0 108.063 179.306 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 92.5 Cg_endo -70.67 -33.99 12.27 Favored 'Trans proline' 0 N--CA 1.46 -0.482 0 CA-C-N 122.163 1.808 . . . . 0.0 113.341 -177.545 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 35.7 t -77.31 -36.3 23.77 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.31 0 N-CA-C 107.209 -1.404 . . . . 0.0 107.209 179.187 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 73.9 mt-10 -61.28 -54.1 48.35 Favored 'General case' 0 C--N 1.343 0.285 0 N-CA-C 107.523 -1.288 . . . . 0.0 107.523 178.709 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -57.34 -46.53 83.2 Favored 'General case' 0 C--O 1.217 -0.623 0 C-N-CA 125.068 1.347 . . . . 0.0 111.181 -179.838 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 13.3 tt0 -58.37 -51.38 70.07 Favored 'General case' 0 N--CA 1.452 -0.33 0 CA-C-O 118.726 -0.654 . . . . 0.0 111.204 179.745 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 85.5 m -57.33 -52.5 65.12 Favored 'General case' 0 CA--C 1.536 0.423 0 CA-C-N 118.766 0.712 . . . . 0.0 109.52 179.454 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 96.0 mt -56.89 -47.53 82.94 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.178 0 C-N-CA 123.392 0.677 . . . . 0.0 110.356 -179.299 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 33.1 ttt85 -61.78 -44.83 96.12 Favored 'General case' 0 N--CA 1.448 -0.545 0 C-N-CA 123.875 0.87 . . . . 0.0 111.769 -179.082 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 14.0 mptt -59.17 -51.22 70.95 Favored 'General case' 0 CA--C 1.516 -0.33 0 CA-C-N 118.549 0.613 . . . . 0.0 109.649 179.469 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 4.6 mptp? -62.9 -47.18 84.4 Favored 'General case' 0 CA--C 1.515 -0.379 0 CA-C-O 118.135 -0.936 . . . . 0.0 110.637 -179.01 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -56.15 -55.48 32.6 Favored 'General case' 0 N--CA 1.451 -0.391 0 C-N-CA 124.217 1.007 . . . . 0.0 109.776 179.505 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 5.3 tt0 -60.25 -38.65 84.13 Favored 'General case' 0 C--O 1.234 0.241 0 O-C-N 123.54 0.525 . . . . 0.0 111.545 -178.113 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -72.08 -24.93 61.58 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 123.872 0.869 . . . . 0.0 111.196 179.458 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 2.2 t -83.52 -8.15 59.4 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 126.477 1.911 . . . . 0.0 109.023 178.129 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 77.88 8.66 87.27 Favored Glycine 0 CA--C 1.529 0.957 0 CA-C-O 118.812 -0.994 . . . . 0.0 111.716 -179.029 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 40.1 mt -116.55 154.98 29.47 Favored 'General case' 0 N--CA 1.452 -0.344 0 CA-C-N 119.758 1.779 . . . . 0.0 111.457 -178.435 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . 0.433 HG22 ' H ' ' A' ' 40' ' ' THR . 0.9 OUTLIER -74.99 151.61 38.78 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 104.116 -2.549 . . . . 0.0 104.116 176.159 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 19.4 m -51.2 -31.29 11.06 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.929 0 CA-C-N 114.873 -1.058 . . . . 0.0 110.937 178.93 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 29.3 t -61.0 -58.94 6.32 Favored 'General case' 0 CA--C 1.536 0.435 0 CA-C-N 119.421 1.009 . . . . 0.0 108.936 178.549 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -58.98 -39.52 82.02 Favored 'General case' 0 C--O 1.223 -0.3 0 C-N-CA 123.662 0.785 . . . . 0.0 109.385 178.78 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 77.8 t80 -60.78 -50.19 74.45 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-O 119.084 -0.484 . . . . 0.0 109.737 179.059 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 10.8 mm -55.6 -62.96 0.66 Allowed 'Isoleucine or valine' 0 N--CA 1.463 0.182 0 C-N-CA 125.272 1.429 . . . . 0.0 109.904 179.99 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 27.3 ptt180 -53.08 -44.09 67.28 Favored 'General case' 0 N--CA 1.454 -0.271 0 C-N-CA 123.293 0.637 . . . . 0.0 110.708 -178.579 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 39.1 t30 -63.2 -55.98 20.5 Favored 'General case' 0 N--CA 1.45 -0.444 0 C-N-CA 123.502 0.721 . . . . 0.0 111.583 -179.798 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -61.35 -28.35 69.16 Favored 'General case' 0 N--CA 1.463 0.223 0 C-N-CA 123.965 0.906 . . . . 0.0 112.096 -178.91 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -74.93 -27.62 60.28 Favored 'General case' 0 N--CA 1.453 -0.281 0 N-CA-C 113.022 0.749 . . . . 0.0 113.022 -179.468 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 13.7 mt -93.83 -44.64 8.02 Favored 'General case' 0 C--N 1.332 -0.193 0 C-N-CA 122.849 0.46 . . . . 0.0 110.747 -179.378 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 79.1 m-20 . . . . . 0 C--O 1.244 0.789 0 C-N-CA 124.622 1.169 . . . . 0.0 111.249 -178.229 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B ' 1' ' ' SER . . . . . . . . . . . . . 20.4 m . . . . . 0 N--CA 1.478 0.958 0 CA-C-O 121.758 0.79 . . . . 0.0 111.46 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B ' 2' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -46.45 31.73 0.0 OUTLIER 'General case' 0 CA--C 1.536 0.414 1 C-N-CA 142.201 8.2 . . . . 0.0 114.608 -179.657 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 3' ' ' SER . . . . . . . . . . . . . 16.8 p -67.27 63.62 0.06 Allowed 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 128.924 2.89 . . . . 0.0 114.121 -178.89 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 4' ' ' ALA . . . . . . . . . . . . . . . -58.19 -18.36 25.36 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 124.449 1.099 . . . . 0.0 112.481 179.356 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 4.5 m -55.35 -28.0 21.36 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.412 0 C-N-CA 126.916 2.086 . . . . 0.0 114.178 179.625 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 6' ' ' ARG . . . . . . . . . . . . . 58.9 ttp180 -149.81 130.86 14.39 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-N 120.94 1.7 . . . . 0.0 110.127 -179.448 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 59.3 mttt -74.17 -63.32 1.25 Allowed 'General case' 0 N--CA 1.465 0.305 0 CA-C-O 118.242 -0.885 . . . . 0.0 111.3 179.98 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 23.5 mtpt -144.3 -178.28 5.89 Favored 'General case' 0 N--CA 1.471 0.601 0 CA-C-N 120.324 1.42 . . . . 0.0 109.565 179.775 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -151.94 113.7 4.4 Favored 'General case' 0 N--CA 1.454 -0.251 0 N-CA-C 105.202 -2.147 . . . . 0.0 105.202 178.31 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 10' ' ' GLU . . . . . . . . . . . . . 14.0 pt-20 -111.49 18.21 19.34 Favored 'General case' 0 C--O 1.236 0.366 0 C-N-CA 124.418 1.087 . . . . 0.0 112.769 -178.719 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 11' ' ' VAL . . . . . . . . . . . . . 9.7 m -60.99 154.61 4.45 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.303 0 C-N-CA 124.929 1.291 . . . . 0.0 110.14 179.134 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 12' ' ' ARG . . . . . . . . . . . . . 4.9 ptm180 -130.47 6.45 4.82 Favored 'General case' 0 N--CA 1.466 0.366 0 C-N-CA 123.417 0.687 . . . . 0.0 112.474 179.819 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 13' ' ' GLN . . . . . . . . . . . . . 71.7 mt-30 -122.39 91.51 3.52 Favored 'General case' 0 N--CA 1.45 -0.469 0 N-CA-C 106.598 -1.63 . . . . 0.0 106.598 179.357 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 20.1 ptmt -63.26 -25.79 68.48 Favored 'General case' 0 CA--C 1.531 0.25 0 O-C-N 122.173 -0.33 . . . . 0.0 111.069 179.369 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 3.4 t -72.62 176.45 5.47 Favored 'General case' 0 N--CA 1.451 -0.378 0 N-CA-C 108.567 -0.901 . . . . 0.0 108.567 178.518 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 12.1 t -128.46 115.82 39.29 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.663 0 N-CA-C 103.944 -2.613 . . . . 0.0 103.944 178.954 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 9.0 p -116.74 107.14 21.69 Favored 'Isoleucine or valine' 0 C--O 1.237 0.396 0 CA-C-O 121.957 0.884 . . . . 0.0 110.819 -178.898 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 36.4 mtt180 -133.64 -175.7 3.91 Favored 'General case' 0 C--O 1.239 0.525 0 N-CA-C 108.622 -0.881 . . . . 0.0 108.622 178.189 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 1.9 m -122.34 105.91 10.61 Favored 'General case' 0 N--CA 1.448 -0.555 0 N-CA-C 102.155 -3.276 . . . . 0.0 102.155 178.621 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 15.5 tp -112.27 89.74 3.15 Favored 'General case' 0 N--CA 1.442 -0.836 0 C-N-CA 125.241 1.416 . . . . 0.0 110.454 -177.975 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -63.38 157.42 23.18 Favored 'General case' 0 N--CA 1.452 -0.347 0 C-N-CA 124.614 1.166 . . . . 0.0 110.125 178.177 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 22' ' ' PHE . . . . . . . . . . . . . 88.2 m-85 -138.65 143.63 39.32 Favored 'General case' 0 C--O 1.236 0.389 0 N-CA-C 103.915 -2.624 . . . . 0.0 103.915 177.198 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 23' ' ' SER . . . . . 0.407 ' HB3' ' HD2' ' B' ' 24' ' ' PRO . 3.3 m -73.88 169.41 18.94 Favored Pre-proline 0 C--N 1.32 -0.692 0 C-N-CA 124.204 1.002 . . . . 0.0 109.535 -179.144 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 24' ' ' PRO . . . . . 0.407 ' HD2' ' HB3' ' B' ' 23' ' ' SER . 33.9 Cg_endo -63.25 -43.61 17.93 Favored 'Trans proline' 0 N--CA 1.46 -0.493 0 C-N-CA 121.401 1.401 . . . . 0.0 111.277 -179.371 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 25' ' ' VAL . . . . . . . . . . . . . 24.6 t -66.68 -39.91 84.88 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.298 0 C-N-CA 124.575 1.15 . . . . 0.0 110.313 -179.92 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 83.7 mt-10 -67.13 -44.25 80.34 Favored 'General case' 0 C--N 1.339 0.115 0 N-CA-C 109.359 -0.608 . . . . 0.0 109.359 -179.854 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 27' ' ' ASP . . . . . . . . . . . . . 28.9 t70 -61.3 -44.86 96.51 Favored 'General case' 0 C--O 1.214 -0.783 0 C-N-CA 123.739 0.815 . . . . 0.0 109.131 179.305 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 28' ' ' GLU . . . . . . . . . . . . . 72.7 tt0 -57.64 -52.91 63.51 Favored 'General case' 0 N--CA 1.445 -0.698 0 C-N-CA 125.019 1.328 . . . . 0.0 108.892 178.398 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 96.2 m -60.49 -53.39 58.1 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-N 120.343 1.429 . . . . 0.0 110.36 179.316 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 50.4 mt -55.3 -49.98 68.43 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.272 0 C-N-CA 123.099 0.559 . . . . 0.0 109.761 -179.513 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 31.8 ttt85 -62.09 -43.4 98.92 Favored 'General case' 0 CA--C 1.51 -0.593 0 CA-C-O 117.425 -1.274 . . . . 0.0 110.908 -179.17 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 9.7 mptt -61.11 -48.81 79.95 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 119.85 1.205 . . . . 0.0 109.164 -179.828 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -63.61 -49.34 73.69 Favored 'General case' 0 N--CA 1.455 -0.186 0 CA-C-N 117.988 0.358 . . . . 0.0 110.183 -179.133 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 34' ' ' ALA . . . . . . . . . . . . . . . -56.3 -57.04 13.96 Favored 'General case' 0 N--CA 1.452 -0.326 0 C-N-CA 126.41 1.884 . . . . 0.0 111.069 179.866 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 59.8 tt0 -60.94 -42.65 98.61 Favored 'General case' 0 C--O 1.233 0.202 0 C-N-CA 125.181 1.392 . . . . 0.0 111.286 -178.454 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 36' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -65.52 -40.86 93.44 Favored 'General case' 0 C--N 1.333 -0.134 0 C-N-CA 123.604 0.762 . . . . 0.0 108.957 179.622 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 37' ' ' SER . . . . . . . . . . . . . 9.9 t -77.77 -4.77 48.1 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 124.151 0.981 . . . . 0.0 110.128 178.553 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 63.53 25.9 69.17 Favored Glycine 0 CA--C 1.529 0.948 0 C-N-CA 124.662 1.125 . . . . 0.0 112.912 -179.842 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 39' ' ' LEU . . . . . . . . . . . . . 40.2 mt -119.19 120.94 38.56 Favored 'General case' 0 CA--C 1.507 -0.692 0 N-CA-C 105.439 -2.06 . . . . 0.0 105.439 179.729 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 40' ' ' THR . . . . . . . . . . . . . 12.8 t -53.54 148.87 8.71 Favored 'General case' 0 C--O 1.237 0.407 0 N-CA-C 108.43 -0.952 . . . . 0.0 108.43 178.44 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 41' ' ' VAL . . . . . . . . . . . . . 22.0 m -48.23 -34.3 4.8 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.721 0 CA-C-N 114.79 -1.096 . . . . 0.0 112.142 -179.149 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 42' ' ' SER . . . . . . . . . . . . . 22.9 t -61.27 -49.96 74.96 Favored 'General case' 0 CA--C 1.544 0.744 0 CA-C-N 119.611 1.096 . . . . 0.0 110.143 178.868 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -67.51 -43.42 80.92 Favored 'General case' 0 C--O 1.225 -0.212 0 C-N-CA 123.592 0.757 . . . . 0.0 109.078 178.722 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 44' ' ' TYR . . . . . . . . . . . . . 74.5 t80 -54.58 -50.47 67.92 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 123.163 0.585 . . . . 0.0 109.722 179.529 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 45' ' ' ILE . . . . . . . . . . . . . 12.4 mm -57.28 -64.23 0.55 Allowed 'Isoleucine or valine' 0 C--N 1.341 0.208 0 C-N-CA 125.762 1.625 . . . . 0.0 110.336 179.834 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 46' ' ' ARG . . . . . . . . . . . . . 21.9 ptt180 -53.12 -46.83 68.92 Favored 'General case' 0 C--O 1.222 -0.361 0 CA-C-O 119.148 -0.453 . . . . 0.0 111.06 -178.267 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 47' ' ' ASN . . . . . . . . . . . . . 34.5 t30 -57.76 -51.57 69.04 Favored 'General case' 0 N--CA 1.453 -0.279 0 CA-C-O 118.819 -0.61 . . . . 0.0 111.288 -179.527 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -61.2 -32.77 72.53 Favored 'General case' 0 CA--C 1.53 0.206 0 C-N-CA 123.326 0.651 . . . . 0.0 111.366 -179.899 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 49' ' ' ALA . . . . . . . . . . . . . . . -77.53 -17.72 57.66 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 124.416 1.086 . . . . 0.0 113.729 -179.438 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 22.0 mt -102.84 -37.24 7.94 Favored 'General case' 0 CA--C 1.517 -0.306 0 CA-C-N 118.857 0.753 . . . . 0.0 110.987 -179.546 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 51' ' ' ASN . . . . . . . . . . . . . 7.4 m-80 . . . . . 0 C--O 1.248 1.02 0 C-N-CA 125.302 1.441 . . . . 0.0 107.953 179.704 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 65.8 p . . . . . 0 N--CA 1.467 0.397 0 N-CA-C 109.315 -0.624 . . . . 0.0 109.315 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 5.7 p-10 -69.07 -15.47 63.45 Favored 'General case' 0 N--CA 1.468 0.465 0 C-N-CA 124.794 1.238 . . . . 0.0 111.288 178.657 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 32.4 t -127.44 139.91 52.51 Favored 'General case' 0 N--CA 1.445 -0.678 0 C-N-CA 125.087 1.355 . . . . 0.0 108.239 179.926 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -170.47 161.17 7.78 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 129.657 3.183 . . . . 0.0 106.92 179.069 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 14.5 m -151.48 173.19 0.95 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.335 0 C-N-CA 124.955 1.302 . . . . 0.0 110.131 179.294 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 20.5 mtp180 -71.39 127.61 33.15 Favored 'General case' 0 C--O 1.232 0.184 0 N-CA-C 105.397 -2.075 . . . . 0.0 105.397 177.934 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -145.1 174.63 10.89 Favored 'General case' 0 C--O 1.237 0.408 0 C-N-CA 123.756 0.822 . . . . 0.0 111.104 179.703 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 10.7 mptt -62.89 137.11 58.18 Favored 'General case' 0 C--O 1.232 0.147 0 C-N-CA 125.474 1.51 . . . . 0.0 109.668 -179.356 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 11.6 t -83.9 75.0 10.15 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-O 121.609 0.718 . . . . 0.0 109.76 179.836 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 71.8 mm-40 -80.84 18.4 1.0 Allowed 'General case' 0 CA--C 1.542 0.639 0 O-C-N 121.066 -1.021 . . . . 0.0 110.758 178.757 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 11.0 p -47.66 -38.7 6.54 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.345 0 C-N-CA 126.997 2.119 . . . . 0.0 112.159 -179.706 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 7.0 ptp180 -65.95 -29.51 69.93 Favored 'General case' 0 C--O 1.233 0.201 0 N-CA-C 114.145 1.165 . . . . 0.0 114.145 -179.552 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . 0.573 HE22 HG12 ' A' ' 17' ' ' VAL . 13.7 tt0 -134.96 87.59 2.35 Favored 'General case' 0 C--O 1.227 -0.106 0 CA-C-N 120.433 1.47 . . . . 0.0 108.849 -179.75 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 21.6 pttm -70.0 -30.76 68.17 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.0 -0.546 . . . . 0.0 111.975 179.501 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . 0.507 ' CG2' HH11 ' B' ' 21' ' ' ARG . 7.2 t -76.74 155.08 33.5 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-O 122.179 0.99 . . . . 0.0 108.861 178.952 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 18.0 t -91.85 149.15 4.22 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.724 0 N-CA-C 106.069 -1.826 . . . . 0.0 106.069 178.297 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . 0.573 HG12 HE22 ' A' ' 13' ' ' GLN . 10.4 p -139.82 90.62 0.6 Allowed 'Isoleucine or valine' 0 N--CA 1.442 -0.863 0 N-CA-C 104.701 -2.333 . . . . 0.0 104.701 177.321 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 50.6 ttt180 -116.02 170.74 8.26 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 114.519 -1.219 . . . . 0.0 108.645 -179.288 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 10.8 m -117.09 128.34 55.05 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 106.846 -1.539 . . . . 0.0 106.846 179.779 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -125.9 150.47 47.91 Favored 'General case' 0 C--O 1.235 0.31 0 C-N-CA 124.949 1.3 . . . . 0.0 109.235 -179.362 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 68.5 mtt180 -137.8 158.7 43.82 Favored 'General case' 0 N--CA 1.447 -0.587 0 C-N-CA 125.411 1.485 . . . . 0.0 108.232 178.439 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 50.0 m-85 -145.12 156.57 43.96 Favored 'General case' 0 C--O 1.237 0.415 0 N-CA-C 107.84 -1.17 . . . . 0.0 107.84 179.687 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -68.91 168.9 12.92 Favored Pre-proline 0 CA--C 1.543 0.704 0 N-CA-C 107.421 -1.326 . . . . 0.0 107.421 178.7 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 25.3 Cg_endo -61.93 -45.06 17.69 Favored 'Trans proline' 0 N--CA 1.456 -0.702 0 CA-C-N 120.701 1.286 . . . . 0.0 111.264 -178.761 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 72.1 t -65.82 -42.6 92.57 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.29 0 C-N-CA 123.077 0.551 . . . . 0.0 109.908 179.536 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 7.2 mm-40 -60.35 -45.38 93.68 Favored 'General case' 0 CA--C 1.531 0.223 0 C-N-CA 123.307 0.643 . . . . 0.0 109.358 -179.893 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 26.9 t70 -66.59 -44.03 83.29 Favored 'General case' 0 C--O 1.221 -0.416 0 CA-C-O 118.984 -0.532 . . . . 0.0 110.223 179.562 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 31.7 tt0 -58.08 -43.55 87.07 Favored 'General case' 0 CA--C 1.531 0.213 0 C-N-CA 124.758 1.223 . . . . 0.0 109.055 178.976 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 37.4 m -61.22 -50.63 72.31 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 124.283 1.033 . . . . 0.0 108.634 179.273 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 64.7 mt -61.49 -41.34 89.68 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.327 0 N-CA-C 109.262 -0.644 . . . . 0.0 109.262 179.677 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 23.3 ttp85 -60.39 -46.39 90.14 Favored 'General case' 0 N--CA 1.461 0.099 0 C-N-CA 124.003 0.921 . . . . 0.0 109.575 -179.627 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 1.9 mptm? -59.98 -59.04 6.05 Favored 'General case' 0 N--CA 1.45 -0.453 0 C-N-CA 124.993 1.317 . . . . 0.0 110.956 179.537 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 17.5 tptt -60.84 -40.86 94.43 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-O 118.576 -0.726 . . . . 0.0 111.588 -177.479 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -58.45 -51.65 68.94 Favored 'General case' 0 N--CA 1.452 -0.348 0 N-CA-C 108.596 -0.89 . . . . 0.0 108.596 178.813 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 21.8 tt0 -62.17 -41.99 98.84 Favored 'General case' 0 CA--C 1.529 0.157 0 C-N-CA 123.238 0.615 . . . . 0.0 112.093 -179.565 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 38.7 t70 -66.56 -22.88 66.15 Favored 'General case' 0 C--O 1.232 0.167 0 C-N-CA 126.562 1.945 . . . . 0.0 111.281 -179.856 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 10.4 t -97.15 -8.28 30.47 Favored 'General case' 0 N--CA 1.449 -0.523 0 C-N-CA 127.076 2.151 . . . . 0.0 110.994 179.688 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 64.11 31.66 81.59 Favored Glycine 0 CA--C 1.532 1.134 0 O-C-N 120.723 -1.236 . . . . 0.0 111.418 -179.327 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 55.7 mt -127.8 132.54 49.47 Favored 'General case' 0 N--CA 1.448 -0.536 0 N-CA-C 105.2 -2.148 . . . . 0.0 105.2 -179.981 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 8.4 t -61.75 152.76 30.35 Favored 'General case' 0 CA--C 1.538 0.5 0 N-CA-C 107.692 -1.225 . . . . 0.0 107.692 178.679 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 24.1 t -48.33 -41.32 10.8 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.289 0 C-N-CA 124.549 1.14 . . . . 0.0 111.755 -179.974 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . 0.432 ' HA ' HD21 ' B' ' 20' ' ' LEU . 13.5 p -63.65 -38.25 90.39 Favored 'General case' 0 CA--C 1.532 0.255 0 O-C-N 121.024 -1.048 . . . . 0.0 112.08 179.841 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -69.66 -46.86 65.17 Favored 'General case' 0 C--O 1.222 -0.354 0 N-CA-C 107.607 -1.257 . . . . 0.0 107.607 178.334 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 69.6 t80 -52.87 -46.31 67.85 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 123.973 0.909 . . . . 0.0 110.112 179.152 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 14.8 mm -56.98 -63.57 0.63 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.315 0 C-N-CA 124.044 0.938 . . . . 0.0 110.526 179.429 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 12.4 ptt180 -55.47 -45.16 76.94 Favored 'General case' 0 C--O 1.222 -0.365 0 C-N-CA 123.497 0.719 . . . . 0.0 110.989 -178.55 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 32.2 t30 -58.69 -55.79 30.6 Favored 'General case' 0 N--CA 1.449 -0.521 0 C-N-CA 124.601 1.16 . . . . 0.0 109.065 -179.189 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -61.77 -25.9 67.75 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 123.065 0.546 . . . . 0.0 112.442 179.637 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -79.07 -19.38 51.44 Favored 'General case' 0 CA--C 1.536 0.44 0 N-CA-C 113.341 0.867 . . . . 0.0 113.341 179.523 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 7.9 mt -115.3 -29.03 6.7 Favored 'General case' 0 N--CA 1.466 0.328 0 N-CA-C 114.133 1.16 . . . . 0.0 114.133 -177.966 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 2.0 m-80 . . . . . 0 C--O 1.249 1.048 0 C-N-CA 125.512 1.525 . . . . 0.0 110.3 -178.183 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B ' 1' ' ' SER . . . . . . . . . . . . . 77.3 p . . . . . 0 N--CA 1.466 0.331 0 CA-C-O 118.802 -0.618 . . . . 0.0 110.671 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B ' 2' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -55.14 -64.23 0.9 Allowed 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 126.667 1.987 . . . . 0.0 109.764 178.328 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 3' ' ' SER . . . . . . . . . . . . . 29.6 t -69.85 103.7 2.27 Favored 'General case' 0 N--CA 1.443 -0.784 0 C-N-CA 127.235 2.214 . . . . 0.0 106.783 179.186 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 4' ' ' ALA . . . . . . . . . . . . . . . -130.25 82.42 2.06 Favored 'General case' 0 CA--C 1.531 0.221 0 C-N-CA 125.243 1.417 . . . . 0.0 111.275 -179.311 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 34.8 m -89.72 173.76 0.85 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.414 0 N-CA-C 108.839 -0.8 . . . . 0.0 108.839 178.53 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 6' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -72.95 141.04 47.8 Favored 'General case' 0 C--O 1.234 0.275 0 O-C-N 121.57 -0.706 . . . . 0.0 109.434 179.033 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -124.79 153.3 42.69 Favored 'General case' 0 C--O 1.237 0.426 0 N-CA-C 106.13 -1.804 . . . . 0.0 106.13 177.403 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 12.1 mptt -72.6 177.12 4.91 Favored 'General case' 0 CA--C 1.538 0.506 0 N-CA-C 107.846 -1.168 . . . . 0.0 107.846 -179.494 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 20.5 t -93.45 97.49 10.58 Favored 'General case' 0 C--N 1.331 -0.229 0 O-C-N 120.409 -1.432 . . . . 0.0 108.513 -179.947 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 10' ' ' GLU . . . . . . . . . . . . . 3.0 pm0 -123.56 7.06 8.89 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 125.069 1.348 . . . . 0.0 111.841 179.366 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 11' ' ' VAL . . . . . . . . . . . . . 13.8 p -53.15 -30.76 17.05 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.379 0 C-N-CA 124.782 1.233 . . . . 0.0 111.631 179.627 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 12' ' ' ARG . . . . . . . . . . . . . 9.5 ptm180 -56.8 -20.26 21.56 Favored 'General case' 0 C--O 1.233 0.21 0 C-N-CA 124.065 0.946 . . . . 0.0 112.637 179.299 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 13' ' ' GLN . . . . . . . . . . . . . 36.9 tt0 -151.36 80.01 1.29 Allowed 'General case' 0 N--CA 1.447 -0.581 0 N-CA-C 106.69 -1.596 . . . . 0.0 106.69 179.89 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 24.3 pttm -64.64 -30.99 72.02 Favored 'General case' 0 N--CA 1.462 0.174 0 C-N-CA 123.946 0.898 . . . . 0.0 112.58 179.538 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 7.9 t -65.09 170.47 4.45 Favored 'General case' 0 N--CA 1.449 -0.483 0 N-CA-C 106.201 -1.777 . . . . 0.0 106.201 178.184 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 9.3 p -109.98 155.99 11.03 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.813 0 N-CA-C 104.619 -2.363 . . . . 0.0 104.619 177.391 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 14.2 p -138.79 122.18 19.3 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.734 0 N-CA-C 106.305 -1.739 . . . . 0.0 106.305 177.964 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 23.8 ttt180 -140.65 159.09 42.97 Favored 'General case' 0 CA--C 1.516 -0.334 0 CA-C-O 122.826 1.298 . . . . 0.0 111.44 179.565 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 1.3 m -108.06 102.47 11.63 Favored 'General case' 0 N--CA 1.445 -0.71 0 N-CA-C 101.294 -3.595 . . . . 0.0 101.294 179.693 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 20' ' ' LEU . . . . . 0.432 HD21 ' HA ' ' A' ' 42' ' ' SER . 0.2 OUTLIER -108.52 120.28 41.98 Favored 'General case' 0 CA--C 1.515 -0.372 0 C-N-CA 124.437 1.095 . . . . 0.0 108.375 -178.504 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 21' ' ' ARG . . . . . 0.507 HH11 ' CG2' ' A' ' 15' ' ' THR . 24.2 mtt180 -95.71 153.65 17.62 Favored 'General case' 0 N--CA 1.449 -0.493 0 N-CA-C 109.109 -0.7 . . . . 0.0 109.109 179.188 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 22' ' ' PHE . . . . . . . . . . . . . 92.9 m-85 -134.88 144.27 47.44 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 106.728 -1.582 . . . . 0.0 106.728 -179.814 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -74.78 171.16 12.28 Favored Pre-proline 0 CA--C 1.544 0.741 0 N-CA-C 108.075 -1.083 . . . . 0.0 108.075 179.948 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 24' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -66.94 -31.32 38.12 Favored 'Trans proline' 0 N--CA 1.459 -0.547 0 C-N-CA 121.472 1.448 . . . . 0.0 113.562 -178.332 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 25' ' ' VAL . . . . . . . . . . . . . 89.8 t -75.37 -40.8 42.81 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.307 0 N-CA-C 109.031 -0.729 . . . . 0.0 109.031 -179.832 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -62.86 -48.18 80.13 Favored 'General case' 0 C--O 1.217 -0.631 0 N-CA-C 108.164 -1.051 . . . . 0.0 108.164 179.889 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 27' ' ' ASP . . . . . . . . . . . . . 20.9 t0 -56.03 -48.51 75.84 Favored 'General case' 0 CA--C 1.515 -0.385 0 C-N-CA 124.899 1.28 . . . . 0.0 111.169 -179.514 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 28' ' ' GLU . . . . . . . . . . . . . 36.1 tt0 -60.51 -47.15 87.42 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 124.58 1.152 . . . . 0.0 108.833 179.097 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 31.7 m -60.89 -55.15 36.37 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 124.167 0.987 . . . . 0.0 110.428 179.484 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 96.7 mt -62.21 -30.83 49.73 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.48 0 C-N-CA 126.132 1.773 . . . . 0.0 110.641 -178.654 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 9.6 ttt85 -67.58 -43.82 79.64 Favored 'General case' 0 C--N 1.327 -0.395 0 O-C-N 120.515 -1.366 . . . . 0.0 110.104 179.437 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 1.2 mptm? -78.47 -44.46 24.53 Favored 'General case' 0 C--O 1.225 -0.214 0 CA-C-O 117.552 -1.213 . . . . 0.0 113.918 -178.07 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 34.9 tptt -62.64 -39.68 94.61 Favored 'General case' 0 N--CA 1.462 0.166 0 CA-C-N 119.966 1.257 . . . . 0.0 110.615 -178.109 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 34' ' ' ALA . . . . . . . . . . . . . . . -58.73 -55.74 31.17 Favored 'General case' 0 N--CA 1.448 -0.539 0 C-N-CA 124.839 1.256 . . . . 0.0 109.019 179.072 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 16.8 tt0 -65.46 -34.89 79.35 Favored 'General case' 0 N--CA 1.453 -0.316 0 CA-C-N 115.37 -0.832 . . . . 0.0 113.027 -178.321 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 36' ' ' ASP . . . . . . . . . . . . . 18.3 t70 -64.86 -40.85 95.79 Favored 'General case' 0 C--O 1.235 0.334 0 N-CA-C 107.929 -1.137 . . . . 0.0 107.929 178.361 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 37' ' ' SER . . . . . . . . . . . . . 6.9 t -77.75 -7.17 56.17 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 124.887 1.275 . . . . 0.0 110.671 178.821 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 72.7 2.54 56.7 Favored Glycine 0 CA--C 1.534 1.265 0 C-N-CA 125.032 1.301 . . . . 0.0 112.257 -179.068 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 39' ' ' LEU . . . . . . . . . . . . . 11.2 mt -99.6 106.31 18.27 Favored 'General case' 0 N--CA 1.447 -0.6 0 C-N-CA 125.952 1.701 . . . . 0.0 107.294 -179.52 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 40' ' ' THR . . . . . . . . . . . . . 8.8 t -45.27 150.83 0.4 Allowed 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 124.947 1.299 . . . . 0.0 109.67 179.016 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 41' ' ' VAL . . . . . . . . . . . . . 65.4 t -43.46 -44.64 1.61 Allowed 'Isoleucine or valine' 0 N--CA 1.461 0.096 0 C-N-CA 125.85 1.66 . . . . 0.0 112.473 -177.705 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 42' ' ' SER . . . . . . . . . . . . . 1.4 p -61.41 -46.75 88.84 Favored 'General case' 0 CA--C 1.538 0.489 0 CA-C-N 119.518 1.053 . . . . 0.0 111.615 179.896 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -66.52 -39.03 88.41 Favored 'General case' 0 C--O 1.225 -0.2 0 C-N-CA 123.251 0.621 . . . . 0.0 109.566 178.557 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 44' ' ' TYR . . . . . . . . . . . . . 61.7 t80 -58.82 -52.85 63.96 Favored 'General case' 0 C--O 1.221 -0.413 0 N-CA-C 108.495 -0.928 . . . . 0.0 108.495 179.134 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 45' ' ' ILE . . . . . . . . . . . . . 21.2 mm -53.45 -61.63 0.84 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.196 0 C-N-CA 124.173 0.989 . . . . 0.0 109.577 179.819 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 46' ' ' ARG . . . . . . . . . . . . . 18.4 ptt180 -52.0 -47.51 64.88 Favored 'General case' 0 CA--C 1.53 0.194 0 N-CA-C 112.704 0.631 . . . . 0.0 112.704 -179.012 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 47' ' ' ASN . . . . . . . . . . . . . 32.6 t30 -66.05 -52.44 48.96 Favored 'General case' 0 C--N 1.329 -0.322 0 C-N-CA 125.37 1.468 . . . . 0.0 112.987 -179.352 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -61.84 -33.26 73.84 Favored 'General case' 0 C--O 1.223 -0.333 0 C-N-CA 125.293 1.437 . . . . 0.0 110.976 -179.594 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 49' ' ' ALA . . . . . . . . . . . . . . . -66.71 -55.57 14.51 Favored 'General case' 0 N--CA 1.444 -0.762 0 C-N-CA 122.41 0.284 . . . . 0.0 111.02 -179.77 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 14.8 mt -69.62 -40.19 76.74 Favored 'General case' 0 CA--C 1.516 -0.341 0 N-CA-C 115.562 1.69 . . . . 0.0 115.562 -177.327 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 51' ' ' ASN . . . . . . . . . . . . . 57.0 m-80 . . . . . 0 C--O 1.251 1.153 0 CA-C-O 118.321 -0.847 . . . . 0.0 111.165 -176.774 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 44.5 m . . . . . 0 N--CA 1.47 0.533 0 N-CA-C 107.496 -1.298 . . . . 0.0 107.496 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 44.6 m-20 -71.76 174.49 6.77 Favored 'General case' 0 C--O 1.237 0.433 0 C-N-CA 123.393 0.677 . . . . 0.0 111.803 -178.092 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 19.3 p -136.02 171.49 14.4 Favored 'General case' 0 C--O 1.234 0.265 0 C-N-CA 125.18 1.392 . . . . 0.0 110.462 -179.831 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -71.56 102.43 2.72 Favored 'General case' 0 N--CA 1.453 -0.311 0 N-CA-C 105.521 -2.029 . . . . 0.0 105.521 178.358 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 12.5 p -123.16 -36.61 1.2 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 C-N-CA 124.78 1.232 . . . . 0.0 110.047 -178.822 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 29.5 mtp-105 -86.4 160.86 18.93 Favored 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 125.598 1.559 . . . . 0.0 106.817 178.838 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 28.7 mtpt -129.52 -92.84 0.44 Allowed 'General case' 0 N--CA 1.465 0.279 0 O-C-N 121.144 -0.973 . . . . 0.0 108.987 -179.866 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 18.9 pttp -135.69 105.95 6.37 Favored 'General case' 0 C--O 1.235 0.293 0 C-N-CA 124.676 1.19 . . . . 0.0 110.426 -179.456 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 65.8 m -144.75 131.39 19.97 Favored 'General case' 0 C--N 1.332 -0.163 0 C-N-CA 124.209 1.003 . . . . 0.0 108.328 178.847 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 -94.34 81.47 4.0 Favored 'General case' 0 C--N 1.331 -0.221 0 N-CA-C 108.8 -0.815 . . . . 0.0 108.8 -179.274 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 94.7 t -138.11 129.75 38.43 Favored 'Isoleucine or valine' 0 C--O 1.235 0.316 0 N-CA-C 106.261 -1.755 . . . . 0.0 106.261 179.379 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 24.9 ptt180 -130.76 86.37 2.37 Favored 'General case' 0 C--N 1.333 -0.15 0 C-N-CA 124.679 1.192 . . . . 0.0 108.514 -179.866 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 13.8 pt20 -127.05 104.33 7.93 Favored 'General case' 0 CA--C 1.519 -0.226 0 C-N-CA 125.065 1.346 . . . . 0.0 109.941 -179.517 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 15.0 ptmt -98.25 27.41 4.67 Favored 'General case' 0 C--N 1.327 -0.386 0 O-C-N 121.65 -0.656 . . . . 0.0 109.955 178.45 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 11.8 t -160.89 159.46 29.74 Favored 'General case' 0 N--CA 1.437 -1.1 0 N-CA-C 107.844 -1.169 . . . . 0.0 107.844 179.398 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 95.9 t -97.28 154.64 3.69 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.879 0 N-CA-C 104.457 -2.423 . . . . 0.0 104.457 177.835 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 8.3 p -144.09 101.85 0.7 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.532 0 N-CA-C 105.598 -2.001 . . . . 0.0 105.598 178.68 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 10.6 ttm180 -144.09 172.7 12.53 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 107.843 -1.169 . . . . 0.0 107.843 179.392 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -121.59 136.87 54.93 Favored 'General case' 0 C--N 1.321 -0.637 0 C-N-CA 127.217 2.207 . . . . 0.0 107.597 -179.567 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 74.0 mt -120.84 170.8 9.13 Favored 'General case' 0 C--O 1.236 0.39 0 N-CA-C 107.464 -1.309 . . . . 0.0 107.464 178.547 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 23.4 mmt-85 -128.77 151.16 49.88 Favored 'General case' 0 C--N 1.327 -0.412 0 C-N-CA 124.978 1.311 . . . . 0.0 107.967 179.639 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 98.5 m-85 -147.87 140.91 24.95 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 106.429 -1.693 . . . . 0.0 106.429 179.588 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 1.5 m -68.96 172.14 5.37 Favored Pre-proline 0 CA--C 1.545 0.755 0 C-N-CA 124.26 1.024 . . . . 0.0 108.664 179.381 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 59.4 Cg_endo -67.72 -38.28 14.21 Favored 'Trans proline' 0 N--CA 1.458 -0.609 0 CA-C-N 121.271 1.49 . . . . 0.0 111.351 -179.067 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 21.3 t -72.46 -36.38 54.34 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.488 0 C-N-CA 123.105 0.562 . . . . 0.0 109.796 179.632 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -67.85 -42.66 81.03 Favored 'General case' 0 C--O 1.225 -0.224 0 N-CA-C 108.724 -0.843 . . . . 0.0 108.724 179.377 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 26.5 t70 -65.4 -46.02 81.68 Favored 'General case' 0 C--O 1.224 -0.286 0 N-CA-C 108.915 -0.772 . . . . 0.0 108.915 178.763 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 63.9 tt0 -54.74 -48.57 72.4 Favored 'General case' 0 N--CA 1.452 -0.367 0 C-N-CA 125.112 1.365 . . . . 0.0 108.052 178.23 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 46.1 m -67.51 -51.31 52.6 Favored 'General case' 0 C--O 1.222 -0.388 0 C-N-CA 124.149 0.98 . . . . 0.0 111.3 -179.441 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 59.6 mt -60.25 -31.96 49.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 O-C-N 120.52 -1.363 . . . . 0.0 110.109 -179.436 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 31.9 ttt180 -76.24 -45.14 34.31 Favored 'General case' 0 CA--C 1.511 -0.545 0 N-CA-C 109.318 -0.623 . . . . 0.0 109.318 -179.151 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . 0.391 0.0 OUTLIER -66.04 -30.64 71.21 Favored 'General case' 0 N--CA 1.45 -0.447 0 O-C-N 123.277 0.361 . . . . 0.0 110.259 -179.856 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 7.4 mmmm -77.48 -48.91 15.92 Favored 'General case' 0 C--O 1.222 -0.362 0 N-CA-C 107.346 -1.353 . . . . 0.0 107.346 178.178 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -54.4 -57.14 12.45 Favored 'General case' 0 C--N 1.339 0.112 0 C-N-CA 124.083 0.953 . . . . 0.0 110.278 -179.803 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 7.5 tp10 -62.96 -41.26 99.47 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-O 118.881 -0.581 . . . . 0.0 111.845 -179.059 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 37.0 t70 -66.36 -26.84 67.46 Favored 'General case' 0 N--CA 1.47 0.571 0 CA-C-N 119.435 1.016 . . . . 0.0 110.724 179.771 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 1.7 t -89.81 -2.28 58.18 Favored 'General case' 0 N--CA 1.447 -0.625 0 C-N-CA 124.533 1.133 . . . . 0.0 110.119 178.861 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 65.23 33.97 88.29 Favored Glycine 0 CA--C 1.526 0.77 0 CA-C-O 118.835 -0.98 . . . . 0.0 112.569 179.627 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 81.0 mt -128.29 152.58 47.96 Favored 'General case' 0 C--O 1.233 0.23 0 C-N-CA 125.502 1.521 . . . . 0.0 108.589 179.924 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -76.71 148.48 36.75 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 104.24 -2.504 . . . . 0.0 104.24 177.183 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 20.1 t -50.35 -39.78 17.35 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.539 0 C-N-CA 124.683 1.193 . . . . 0.0 109.477 177.844 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 66.2 p -58.75 -48.14 82.24 Favored 'General case' 0 CA--C 1.539 0.555 0 O-C-N 121.105 -0.997 . . . . 0.0 111.777 179.47 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -67.6 -46.44 72.58 Favored 'General case' 0 C--O 1.221 -0.403 0 C-N-CA 125.09 1.356 . . . . 0.0 108.581 179.053 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 55.0 t80 -52.66 -53.66 44.09 Favored 'General case' 0 N--CA 1.451 -0.379 0 C-N-CA 124.703 1.201 . . . . 0.0 109.487 179.959 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 18.4 mm -51.94 -62.11 0.63 Allowed 'Isoleucine or valine' 0 C--N 1.341 0.218 0 C-N-CA 124.575 1.15 . . . . 0.0 111.258 -179.784 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 12.7 ptm180 -60.92 -46.28 91.31 Favored 'General case' 0 C--O 1.222 -0.374 0 CA-C-O 118.687 -0.673 . . . . 0.0 111.687 -178.682 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 10.7 t30 -51.96 -55.22 21.7 Favored 'General case' 0 C--N 1.332 -0.184 0 C-N-CA 124.405 1.082 . . . . 0.0 110.089 -179.443 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -66.18 -29.83 70.18 Favored 'General case' 0 N--CA 1.453 -0.298 0 C-N-CA 124.99 1.316 . . . . 0.0 113.149 179.924 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -81.38 -19.8 41.9 Favored 'General case' 0 N--CA 1.462 0.151 0 N-CA-C 113.362 0.875 . . . . 0.0 113.362 -179.303 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 23.4 mt -106.19 -36.98 6.73 Favored 'General case' 0 CA--C 1.516 -0.332 0 N-CA-C 114.015 1.117 . . . . 0.0 114.015 -178.533 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 12.7 m-80 . . . . . 0 C--O 1.248 1.015 0 CA-C-O 117.805 -1.093 . . . . 0.0 110.972 -176.975 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' B' B ' 1' ' ' SER . . . . . . . . . . . . . 38.2 m . . . . . 0 C--O 1.237 0.418 0 CA-C-O 120.409 0.147 . . . . 0.0 110.819 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' B' B ' 2' ' ' ASP . . . . . . . . . . . . . 3.5 p-10 -92.96 166.03 12.58 Favored 'General case' 0 N--CA 1.464 0.261 0 C-N-CA 124.259 1.024 . . . . 0.0 108.867 178.791 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 3' ' ' SER . . . . . . . . . . . . . 51.5 p -135.34 163.82 29.14 Favored 'General case' 0 C--O 1.241 0.609 0 C-N-CA 124.683 1.193 . . . . 0.0 111.394 -178.909 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 4' ' ' ALA . . . . . . . . . . . . . . . -78.54 75.96 5.05 Favored 'General case' 0 N--CA 1.451 -0.389 0 C-N-CA 124.907 1.283 . . . . 0.0 108.58 178.995 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 10.4 p -79.63 -27.19 12.62 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.543 0 C-N-CA 123.909 0.884 . . . . 0.0 108.931 178.952 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 6' ' ' ARG . . . . . . . . . . . . . 87.0 mtt180 -70.64 163.39 27.15 Favored 'General case' 0 CA--C 1.534 0.338 0 N-CA-C 108.528 -0.915 . . . . 0.0 108.528 178.274 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 54.0 mtpt -133.4 -77.37 0.48 Allowed 'General case' 0 N--CA 1.467 0.384 0 O-C-N 121.263 -0.898 . . . . 0.0 109.955 -179.824 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 13.0 pttp -154.51 88.07 1.2 Allowed 'General case' 0 N--CA 1.456 -0.161 0 C-N-CA 123.806 0.842 . . . . 0.0 109.128 -179.486 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 33.3 m -136.08 136.49 40.21 Favored 'General case' 0 C--O 1.235 0.327 0 N-CA-C 107.773 -1.195 . . . . 0.0 107.773 179.517 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 10' ' ' GLU . . . . . . . . . . . . . 3.6 tt0 -99.62 0.73 42.68 Favored 'General case' 0 CA--C 1.532 0.287 0 N-CA-C 115.543 1.683 . . . . 0.0 115.543 -177.819 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 11' ' ' VAL . . . . . . . . . . . . . 89.4 t -74.34 138.72 20.55 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 N-CA-C 107.725 -1.213 . . . . 0.0 107.725 179.631 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 12' ' ' ARG . . . . . . . . . . . . . 80.5 mtt180 -140.0 130.68 25.78 Favored 'General case' 0 C--O 1.236 0.389 0 CA-C-N 119.29 0.95 . . . . 0.0 110.823 -179.536 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 13' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -148.21 96.39 2.62 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 124.171 0.988 . . . . 0.0 109.878 178.623 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 12.7 ptmt -80.25 23.96 0.46 Allowed 'General case' 0 N--CA 1.466 0.363 0 O-C-N 120.974 -1.079 . . . . 0.0 110.713 179.158 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 14.3 t -167.37 164.13 15.16 Favored 'General case' 0 N--CA 1.44 -0.955 0 C-N-CA 126.213 1.805 . . . . 0.0 106.634 -179.637 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 5.4 t -109.8 156.97 10.47 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.574 0 N-CA-C 106.515 -1.661 . . . . 0.0 106.515 177.909 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 11.5 p -137.69 113.67 11.06 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.681 0 N-CA-C 105.182 -2.155 . . . . 0.0 105.182 176.939 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 34.5 ttm-85 -145.19 149.11 34.37 Favored 'General case' 0 CA--C 1.514 -0.422 0 CA-C-O 121.059 0.457 . . . . 0.0 109.8 178.936 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -93.85 132.77 37.93 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 107.402 -1.333 . . . . 0.0 107.402 -179.482 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 69.9 mt -129.49 151.96 49.54 Favored 'General case' 0 C--O 1.239 0.542 0 N-CA-C 107.532 -1.284 . . . . 0.0 107.532 178.747 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 22.0 mmt85 -112.6 151.19 30.37 Favored 'General case' 0 C--N 1.323 -0.571 0 C-N-CA 127.977 2.511 . . . . 0.0 108.234 -179.798 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 22' ' ' PHE . . . . . . . . . . . . . 89.7 m-85 -148.73 139.43 22.78 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 104.829 -2.285 . . . . 0.0 104.829 178.769 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 4.7 m -70.57 168.54 18.97 Favored Pre-proline 0 CA--C 1.551 1.012 0 N-CA-C 108.279 -1.008 . . . . 0.0 108.279 179.408 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 24' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -66.14 -40.88 14.33 Favored 'Trans proline' 0 N--CA 1.46 -0.456 0 C-N-CA 122.475 2.117 . . . . 0.0 114.178 -177.363 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 25' ' ' VAL . . . . . . . . . . . . . 77.1 t -66.81 -45.62 87.31 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.305 0 C-N-CA 123.94 0.896 . . . . 0.0 109.51 -179.709 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -68.08 -38.85 82.84 Favored 'General case' 0 N--CA 1.453 -0.297 0 C-N-CA 124.68 1.192 . . . . 0.0 110.983 -178.495 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 27' ' ' ASP . . . . . . . . . . . . . 10.1 t70 -64.59 -44.1 91.7 Favored 'General case' 0 N--CA 1.454 -0.264 0 C-N-CA 123.102 0.561 . . . . 0.0 109.998 178.473 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 28' ' ' GLU . . . . . . . . . . . . . 26.5 tt0 -62.16 -45.75 92.02 Favored 'General case' 0 N--CA 1.449 -0.514 0 N-CA-C 108.105 -1.072 . . . . 0.0 108.105 179.556 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 31.0 m -56.06 -52.91 62.56 Favored 'General case' 0 C--N 1.341 0.199 0 N-CA-C 108.512 -0.921 . . . . 0.0 108.512 178.699 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 84.4 mt -58.0 -41.17 79.66 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.3 0 C-N-CA 122.66 0.384 . . . . 0.0 110.099 -179.717 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 37.4 ttt-85 -61.42 -47.43 85.81 Favored 'General case' 0 C--O 1.23 0.067 0 O-C-N 121.45 -0.781 . . . . 0.0 110.62 -179.647 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 2.6 mptm? -65.48 -46.83 78.2 Favored 'General case' 0 CA--C 1.523 -0.083 0 C-N-CA 123.008 0.523 . . . . 0.0 110.473 -179.593 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 9.1 mmmm -59.46 -48.31 82.13 Favored 'General case' 0 CA--C 1.527 0.065 0 N-CA-C 109.272 -0.64 . . . . 0.0 109.272 -179.655 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 34' ' ' ALA . . . . . . . . . . . . . . . -59.43 -49.77 76.52 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 124.768 1.227 . . . . 0.0 112.156 -179.821 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 5.4 tp10 -56.0 -49.69 72.94 Favored 'General case' 0 C--O 1.233 0.186 0 C-N-CA 124.414 1.086 . . . . 0.0 110.696 -179.495 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 36' ' ' ASP . . . . . . . . . . . . . 6.8 t70 -67.89 -44.05 77.88 Favored 'General case' 0 N--CA 1.454 -0.262 0 C-N-CA 124.107 0.963 . . . . 0.0 111.875 -178.927 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 37' ' ' SER . . . . . . . . . . . . . 30.4 t -66.24 -18.77 65.56 Favored 'General case' 0 N--CA 1.448 -0.556 0 C-N-CA 124.403 1.081 . . . . 0.0 110.943 -179.453 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 73.47 20.35 79.84 Favored Glycine 0 CA--C 1.528 0.893 0 N-CA-C 110.632 -0.987 . . . . 0.0 110.632 -179.189 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 39' ' ' LEU . . . . . . . . . . . . . 81.4 mt -120.45 107.81 13.34 Favored 'General case' 0 N--CA 1.447 -0.576 0 N-CA-C 103.121 -2.918 . . . . 0.0 103.121 179.56 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 40' ' ' THR . . . . . . . . . . . . . 13.8 t -50.76 156.3 0.98 Allowed 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 123.342 0.657 . . . . 0.0 109.502 -179.776 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 41' ' ' VAL . . . . . . . . . . . . . 80.8 t -44.99 -43.97 2.72 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.418 0 C-N-CA 125.019 1.328 . . . . 0.0 112.804 -177.74 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 42' ' ' SER . . . . . . . . . . . . . 9.8 p -65.48 -42.77 91.85 Favored 'General case' 0 CA--C 1.542 0.642 0 CA-C-N 119.256 0.935 . . . . 0.0 112.276 179.474 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -66.31 -45.39 80.53 Favored 'General case' 0 C--O 1.226 -0.183 0 C-N-CA 125.545 1.538 . . . . 0.0 108.921 178.941 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 44' ' ' TYR . . . . . . . . . . . . . 72.3 t80 -56.25 -51.31 68.6 Favored 'General case' 0 N--CA 1.443 -0.781 0 C-N-CA 125.685 1.594 . . . . 0.0 109.256 179.627 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 45' ' ' ILE . . . . . . . . . . . . . 9.0 mm -56.12 -58.94 3.41 Favored 'Isoleucine or valine' 0 C--N 1.34 0.162 0 C-N-CA 123.427 0.691 . . . . 0.0 110.952 179.561 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 46' ' ' ARG . . . . . . . . . . . . . 13.3 ptm180 -57.52 -48.97 77.84 Favored 'General case' 0 C--O 1.221 -0.426 0 CA-C-O 118.213 -0.898 . . . . 0.0 111.113 -178.832 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 47' ' ' ASN . . . . . . . . . . . . . 20.1 t30 -55.4 -55.94 25.89 Favored 'General case' 0 N--CA 1.452 -0.349 0 CA-C-N 118.935 0.789 . . . . 0.0 110.837 -179.493 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -59.9 -26.8 66.2 Favored 'General case' 0 CA--C 1.531 0.245 0 C-N-CA 123.529 0.732 . . . . 0.0 112.816 -179.486 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 49' ' ' ALA . . . . . . . . . . . . . . . -84.29 -12.48 54.59 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 124.176 0.991 . . . . 0.0 113.073 179.746 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 14.2 mt -109.99 -30.06 7.96 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 118.856 0.753 . . . . 0.0 111.481 179.749 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 51' ' ' ASN . . . . . . . . . . . . . 11.8 m-80 . . . . . 0 C--O 1.249 1.048 0 C-N-CA 126.057 1.743 . . . . 0.0 109.805 -178.815 . . . . . . . . 0 0 . 1 stop_ save_